Descriptor List¶
preset descriptors
calc = Calculator(descriptors)
# | module | name | constructor | dim |
---|---|---|---|---|
1 | ABCIndex |
ABC | ABCIndex () |
2D |
2 | ABCGG | ABCGGIndex () |
2D | |
3 | AcidBase |
nAcid | AcidicGroupCount () |
2D |
4 | nBase | BasicGroupCount () |
2D | |
5 | AdjacencyMatrix |
SpAbs_A | AdjacencyMatrix (‘SpAbs’) |
2D |
6 | SpMax_A | AdjacencyMatrix (‘SpMax’) |
2D | |
7 | SpDiam_A | AdjacencyMatrix (‘SpDiam’) |
2D | |
8 | SpAD_A | AdjacencyMatrix (‘SpAD’) |
2D | |
9 | SpMAD_A | AdjacencyMatrix (‘SpMAD’) |
2D | |
10 | LogEE_A | AdjacencyMatrix (‘LogEE’) |
2D | |
11 | SM1_A | AdjacencyMatrix (‘SM1’) |
2D | |
12 | VE1_A | AdjacencyMatrix (‘VE1’) |
2D | |
13 | VE2_A | AdjacencyMatrix (‘VE2’) |
2D | |
14 | VE3_A | AdjacencyMatrix (‘VE3’) |
2D | |
15 | VR1_A | AdjacencyMatrix (‘VR1’) |
2D | |
16 | VR2_A | AdjacencyMatrix (‘VR2’) |
2D | |
17 | VR3_A | AdjacencyMatrix (‘VR3’) |
2D | |
18 | Aromatic |
nAromAtom | AromaticAtomsCount () |
2D |
19 | nAromBond | AromaticBondsCount () |
2D | |
20 | AtomCount |
nAtom | AtomCount (‘Atom’) |
2D |
21 | nHeavyAtom | AtomCount (‘HeavyAtom’) |
2D | |
22 | nSpiro | AtomCount (‘Spiro’) |
2D | |
23 | nBridgehead | AtomCount (‘Bridgehead’) |
2D | |
24 | nH | AtomCount (‘H’) |
2D | |
25 | nB | AtomCount (‘B’) |
2D | |
26 | nC | AtomCount (‘C’) |
2D | |
27 | nN | AtomCount (‘N’) |
2D | |
28 | nO | AtomCount (‘O’) |
2D | |
29 | nS | AtomCount (‘S’) |
2D | |
30 | nP | AtomCount (‘P’) |
2D | |
31 | nF | AtomCount (‘F’) |
2D | |
32 | nCl | AtomCount (‘Cl’) |
2D | |
33 | nBr | AtomCount (‘Br’) |
2D | |
34 | nI | AtomCount (‘I’) |
2D | |
35 | nX | AtomCount (‘X’) |
2D | |
36 | Autocorrelation |
ATS0dv | ATS (0, ‘dv’) |
2D |
37 | ATS1dv | ATS (1, ‘dv’) |
2D | |
38 | ATS2dv | ATS (2, ‘dv’) |
2D | |
39 | ATS3dv | ATS (3, ‘dv’) |
2D | |
40 | ATS4dv | ATS (4, ‘dv’) |
2D | |
41 | ATS5dv | ATS (5, ‘dv’) |
2D | |
42 | ATS6dv | ATS (6, ‘dv’) |
2D | |
43 | ATS7dv | ATS (7, ‘dv’) |
2D | |
44 | ATS8dv | ATS (8, ‘dv’) |
2D | |
45 | ATS0d | ATS (0, ‘d’) |
2D | |
46 | ATS1d | ATS (1, ‘d’) |
2D | |
47 | ATS2d | ATS (2, ‘d’) |
2D | |
48 | ATS3d | ATS (3, ‘d’) |
2D | |
49 | ATS4d | ATS (4, ‘d’) |
2D | |
50 | ATS5d | ATS (5, ‘d’) |
2D | |
51 | ATS6d | ATS (6, ‘d’) |
2D | |
52 | ATS7d | ATS (7, ‘d’) |
2D | |
53 | ATS8d | ATS (8, ‘d’) |
2D | |
54 | ATS0s | ATS (0, ‘s’) |
2D | |
55 | ATS1s | ATS (1, ‘s’) |
2D | |
56 | ATS2s | ATS (2, ‘s’) |
2D | |
57 | ATS3s | ATS (3, ‘s’) |
2D | |
58 | ATS4s | ATS (4, ‘s’) |
2D | |
59 | ATS5s | ATS (5, ‘s’) |
2D | |
60 | ATS6s | ATS (6, ‘s’) |
2D | |
61 | ATS7s | ATS (7, ‘s’) |
2D | |
62 | ATS8s | ATS (8, ‘s’) |
2D | |
63 | ATS0Z | ATS (0, ‘Z’) |
2D | |
64 | ATS1Z | ATS (1, ‘Z’) |
2D | |
65 | ATS2Z | ATS (2, ‘Z’) |
2D | |
66 | ATS3Z | ATS (3, ‘Z’) |
2D | |
67 | ATS4Z | ATS (4, ‘Z’) |
2D | |
68 | ATS5Z | ATS (5, ‘Z’) |
2D | |
69 | ATS6Z | ATS (6, ‘Z’) |
2D | |
70 | ATS7Z | ATS (7, ‘Z’) |
2D | |
71 | ATS8Z | ATS (8, ‘Z’) |
2D | |
72 | ATS0m | ATS (0, ‘m’) |
2D | |
73 | ATS1m | ATS (1, ‘m’) |
2D | |
74 | ATS2m | ATS (2, ‘m’) |
2D | |
75 | ATS3m | ATS (3, ‘m’) |
2D | |
76 | ATS4m | ATS (4, ‘m’) |
2D | |
77 | ATS5m | ATS (5, ‘m’) |
2D | |
78 | ATS6m | ATS (6, ‘m’) |
2D | |
79 | ATS7m | ATS (7, ‘m’) |
2D | |
80 | ATS8m | ATS (8, ‘m’) |
2D | |
81 | ATS0v | ATS (0, ‘v’) |
2D | |
82 | ATS1v | ATS (1, ‘v’) |
2D | |
83 | ATS2v | ATS (2, ‘v’) |
2D | |
84 | ATS3v | ATS (3, ‘v’) |
2D | |
85 | ATS4v | ATS (4, ‘v’) |
2D | |
86 | ATS5v | ATS (5, ‘v’) |
2D | |
87 | ATS6v | ATS (6, ‘v’) |
2D | |
88 | ATS7v | ATS (7, ‘v’) |
2D | |
89 | ATS8v | ATS (8, ‘v’) |
2D | |
90 | ATS0se | ATS (0, ‘se’) |
2D | |
91 | ATS1se | ATS (1, ‘se’) |
2D | |
92 | ATS2se | ATS (2, ‘se’) |
2D | |
93 | ATS3se | ATS (3, ‘se’) |
2D | |
94 | ATS4se | ATS (4, ‘se’) |
2D | |
95 | ATS5se | ATS (5, ‘se’) |
2D | |
96 | ATS6se | ATS (6, ‘se’) |
2D | |
97 | ATS7se | ATS (7, ‘se’) |
2D | |
98 | ATS8se | ATS (8, ‘se’) |
2D | |
99 | ATS0pe | ATS (0, ‘pe’) |
2D | |
100 | ATS1pe | ATS (1, ‘pe’) |
2D | |
101 | ATS2pe | ATS (2, ‘pe’) |
2D | |
102 | ATS3pe | ATS (3, ‘pe’) |
2D | |
103 | ATS4pe | ATS (4, ‘pe’) |
2D | |
104 | ATS5pe | ATS (5, ‘pe’) |
2D | |
105 | ATS6pe | ATS (6, ‘pe’) |
2D | |
106 | ATS7pe | ATS (7, ‘pe’) |
2D | |
107 | ATS8pe | ATS (8, ‘pe’) |
2D | |
108 | ATS0are | ATS (0, ‘are’) |
2D | |
109 | ATS1are | ATS (1, ‘are’) |
2D | |
110 | ATS2are | ATS (2, ‘are’) |
2D | |
111 | ATS3are | ATS (3, ‘are’) |
2D | |
112 | ATS4are | ATS (4, ‘are’) |
2D | |
113 | ATS5are | ATS (5, ‘are’) |
2D | |
114 | ATS6are | ATS (6, ‘are’) |
2D | |
115 | ATS7are | ATS (7, ‘are’) |
2D | |
116 | ATS8are | ATS (8, ‘are’) |
2D | |
117 | ATS0p | ATS (0, ‘p’) |
2D | |
118 | ATS1p | ATS (1, ‘p’) |
2D | |
119 | ATS2p | ATS (2, ‘p’) |
2D | |
120 | ATS3p | ATS (3, ‘p’) |
2D | |
121 | ATS4p | ATS (4, ‘p’) |
2D | |
122 | ATS5p | ATS (5, ‘p’) |
2D | |
123 | ATS6p | ATS (6, ‘p’) |
2D | |
124 | ATS7p | ATS (7, ‘p’) |
2D | |
125 | ATS8p | ATS (8, ‘p’) |
2D | |
126 | ATS0i | ATS (0, ‘i’) |
2D | |
127 | ATS1i | ATS (1, ‘i’) |
2D | |
128 | ATS2i | ATS (2, ‘i’) |
2D | |
129 | ATS3i | ATS (3, ‘i’) |
2D | |
130 | ATS4i | ATS (4, ‘i’) |
2D | |
131 | ATS5i | ATS (5, ‘i’) |
2D | |
132 | ATS6i | ATS (6, ‘i’) |
2D | |
133 | ATS7i | ATS (7, ‘i’) |
2D | |
134 | ATS8i | ATS (8, ‘i’) |
2D | |
135 | AATS0dv | AATS (0, ‘dv’) |
2D | |
136 | AATS1dv | AATS (1, ‘dv’) |
2D | |
137 | AATS2dv | AATS (2, ‘dv’) |
2D | |
138 | AATS3dv | AATS (3, ‘dv’) |
2D | |
139 | AATS4dv | AATS (4, ‘dv’) |
2D | |
140 | AATS5dv | AATS (5, ‘dv’) |
2D | |
141 | AATS6dv | AATS (6, ‘dv’) |
2D | |
142 | AATS7dv | AATS (7, ‘dv’) |
2D | |
143 | AATS8dv | AATS (8, ‘dv’) |
2D | |
144 | AATS0d | AATS (0, ‘d’) |
2D | |
145 | AATS1d | AATS (1, ‘d’) |
2D | |
146 | AATS2d | AATS (2, ‘d’) |
2D | |
147 | AATS3d | AATS (3, ‘d’) |
2D | |
148 | AATS4d | AATS (4, ‘d’) |
2D | |
149 | AATS5d | AATS (5, ‘d’) |
2D | |
150 | AATS6d | AATS (6, ‘d’) |
2D | |
151 | AATS7d | AATS (7, ‘d’) |
2D | |
152 | AATS8d | AATS (8, ‘d’) |
2D | |
153 | AATS0s | AATS (0, ‘s’) |
2D | |
154 | AATS1s | AATS (1, ‘s’) |
2D | |
155 | AATS2s | AATS (2, ‘s’) |
2D | |
156 | AATS3s | AATS (3, ‘s’) |
2D | |
157 | AATS4s | AATS (4, ‘s’) |
2D | |
158 | AATS5s | AATS (5, ‘s’) |
2D | |
159 | AATS6s | AATS (6, ‘s’) |
2D | |
160 | AATS7s | AATS (7, ‘s’) |
2D | |
161 | AATS8s | AATS (8, ‘s’) |
2D | |
162 | AATS0Z | AATS (0, ‘Z’) |
2D | |
163 | AATS1Z | AATS (1, ‘Z’) |
2D | |
164 | AATS2Z | AATS (2, ‘Z’) |
2D | |
165 | AATS3Z | AATS (3, ‘Z’) |
2D | |
166 | AATS4Z | AATS (4, ‘Z’) |
2D | |
167 | AATS5Z | AATS (5, ‘Z’) |
2D | |
168 | AATS6Z | AATS (6, ‘Z’) |
2D | |
169 | AATS7Z | AATS (7, ‘Z’) |
2D | |
170 | AATS8Z | AATS (8, ‘Z’) |
2D | |
171 | AATS0m | AATS (0, ‘m’) |
2D | |
172 | AATS1m | AATS (1, ‘m’) |
2D | |
173 | AATS2m | AATS (2, ‘m’) |
2D | |
174 | AATS3m | AATS (3, ‘m’) |
2D | |
175 | AATS4m | AATS (4, ‘m’) |
2D | |
176 | AATS5m | AATS (5, ‘m’) |
2D | |
177 | AATS6m | AATS (6, ‘m’) |
2D | |
178 | AATS7m | AATS (7, ‘m’) |
2D | |
179 | AATS8m | AATS (8, ‘m’) |
2D | |
180 | AATS0v | AATS (0, ‘v’) |
2D | |
181 | AATS1v | AATS (1, ‘v’) |
2D | |
182 | AATS2v | AATS (2, ‘v’) |
2D | |
183 | AATS3v | AATS (3, ‘v’) |
2D | |
184 | AATS4v | AATS (4, ‘v’) |
2D | |
185 | AATS5v | AATS (5, ‘v’) |
2D | |
186 | AATS6v | AATS (6, ‘v’) |
2D | |
187 | AATS7v | AATS (7, ‘v’) |
2D | |
188 | AATS8v | AATS (8, ‘v’) |
2D | |
189 | AATS0se | AATS (0, ‘se’) |
2D | |
190 | AATS1se | AATS (1, ‘se’) |
2D | |
191 | AATS2se | AATS (2, ‘se’) |
2D | |
192 | AATS3se | AATS (3, ‘se’) |
2D | |
193 | AATS4se | AATS (4, ‘se’) |
2D | |
194 | AATS5se | AATS (5, ‘se’) |
2D | |
195 | AATS6se | AATS (6, ‘se’) |
2D | |
196 | AATS7se | AATS (7, ‘se’) |
2D | |
197 | AATS8se | AATS (8, ‘se’) |
2D | |
198 | AATS0pe | AATS (0, ‘pe’) |
2D | |
199 | AATS1pe | AATS (1, ‘pe’) |
2D | |
200 | AATS2pe | AATS (2, ‘pe’) |
2D | |
201 | AATS3pe | AATS (3, ‘pe’) |
2D | |
202 | AATS4pe | AATS (4, ‘pe’) |
2D | |
203 | AATS5pe | AATS (5, ‘pe’) |
2D | |
204 | AATS6pe | AATS (6, ‘pe’) |
2D | |
205 | AATS7pe | AATS (7, ‘pe’) |
2D | |
206 | AATS8pe | AATS (8, ‘pe’) |
2D | |
207 | AATS0are | AATS (0, ‘are’) |
2D | |
208 | AATS1are | AATS (1, ‘are’) |
2D | |
209 | AATS2are | AATS (2, ‘are’) |
2D | |
210 | AATS3are | AATS (3, ‘are’) |
2D | |
211 | AATS4are | AATS (4, ‘are’) |
2D | |
212 | AATS5are | AATS (5, ‘are’) |
2D | |
213 | AATS6are | AATS (6, ‘are’) |
2D | |
214 | AATS7are | AATS (7, ‘are’) |
2D | |
215 | AATS8are | AATS (8, ‘are’) |
2D | |
216 | AATS0p | AATS (0, ‘p’) |
2D | |
217 | AATS1p | AATS (1, ‘p’) |
2D | |
218 | AATS2p | AATS (2, ‘p’) |
2D | |
219 | AATS3p | AATS (3, ‘p’) |
2D | |
220 | AATS4p | AATS (4, ‘p’) |
2D | |
221 | AATS5p | AATS (5, ‘p’) |
2D | |
222 | AATS6p | AATS (6, ‘p’) |
2D | |
223 | AATS7p | AATS (7, ‘p’) |
2D | |
224 | AATS8p | AATS (8, ‘p’) |
2D | |
225 | AATS0i | AATS (0, ‘i’) |
2D | |
226 | AATS1i | AATS (1, ‘i’) |
2D | |
227 | AATS2i | AATS (2, ‘i’) |
2D | |
228 | AATS3i | AATS (3, ‘i’) |
2D | |
229 | AATS4i | AATS (4, ‘i’) |
2D | |
230 | AATS5i | AATS (5, ‘i’) |
2D | |
231 | AATS6i | AATS (6, ‘i’) |
2D | |
232 | AATS7i | AATS (7, ‘i’) |
2D | |
233 | AATS8i | AATS (8, ‘i’) |
2D | |
234 | ATSC0c | ATSC (0, ‘c’) |
2D | |
235 | ATSC1c | ATSC (1, ‘c’) |
2D | |
236 | ATSC2c | ATSC (2, ‘c’) |
2D | |
237 | ATSC3c | ATSC (3, ‘c’) |
2D | |
238 | ATSC4c | ATSC (4, ‘c’) |
2D | |
239 | ATSC5c | ATSC (5, ‘c’) |
2D | |
240 | ATSC6c | ATSC (6, ‘c’) |
2D | |
241 | ATSC7c | ATSC (7, ‘c’) |
2D | |
242 | ATSC8c | ATSC (8, ‘c’) |
2D | |
243 | ATSC0dv | ATSC (0, ‘dv’) |
2D | |
244 | ATSC1dv | ATSC (1, ‘dv’) |
2D | |
245 | ATSC2dv | ATSC (2, ‘dv’) |
2D | |
246 | ATSC3dv | ATSC (3, ‘dv’) |
2D | |
247 | ATSC4dv | ATSC (4, ‘dv’) |
2D | |
248 | ATSC5dv | ATSC (5, ‘dv’) |
2D | |
249 | ATSC6dv | ATSC (6, ‘dv’) |
2D | |
250 | ATSC7dv | ATSC (7, ‘dv’) |
2D | |
251 | ATSC8dv | ATSC (8, ‘dv’) |
2D | |
252 | ATSC0d | ATSC (0, ‘d’) |
2D | |
253 | ATSC1d | ATSC (1, ‘d’) |
2D | |
254 | ATSC2d | ATSC (2, ‘d’) |
2D | |
255 | ATSC3d | ATSC (3, ‘d’) |
2D | |
256 | ATSC4d | ATSC (4, ‘d’) |
2D | |
257 | ATSC5d | ATSC (5, ‘d’) |
2D | |
258 | ATSC6d | ATSC (6, ‘d’) |
2D | |
259 | ATSC7d | ATSC (7, ‘d’) |
2D | |
260 | ATSC8d | ATSC (8, ‘d’) |
2D | |
261 | ATSC0s | ATSC (0, ‘s’) |
2D | |
262 | ATSC1s | ATSC (1, ‘s’) |
2D | |
263 | ATSC2s | ATSC (2, ‘s’) |
2D | |
264 | ATSC3s | ATSC (3, ‘s’) |
2D | |
265 | ATSC4s | ATSC (4, ‘s’) |
2D | |
266 | ATSC5s | ATSC (5, ‘s’) |
2D | |
267 | ATSC6s | ATSC (6, ‘s’) |
2D | |
268 | ATSC7s | ATSC (7, ‘s’) |
2D | |
269 | ATSC8s | ATSC (8, ‘s’) |
2D | |
270 | ATSC0Z | ATSC (0, ‘Z’) |
2D | |
271 | ATSC1Z | ATSC (1, ‘Z’) |
2D | |
272 | ATSC2Z | ATSC (2, ‘Z’) |
2D | |
273 | ATSC3Z | ATSC (3, ‘Z’) |
2D | |
274 | ATSC4Z | ATSC (4, ‘Z’) |
2D | |
275 | ATSC5Z | ATSC (5, ‘Z’) |
2D | |
276 | ATSC6Z | ATSC (6, ‘Z’) |
2D | |
277 | ATSC7Z | ATSC (7, ‘Z’) |
2D | |
278 | ATSC8Z | ATSC (8, ‘Z’) |
2D | |
279 | ATSC0m | ATSC (0, ‘m’) |
2D | |
280 | ATSC1m | ATSC (1, ‘m’) |
2D | |
281 | ATSC2m | ATSC (2, ‘m’) |
2D | |
282 | ATSC3m | ATSC (3, ‘m’) |
2D | |
283 | ATSC4m | ATSC (4, ‘m’) |
2D | |
284 | ATSC5m | ATSC (5, ‘m’) |
2D | |
285 | ATSC6m | ATSC (6, ‘m’) |
2D | |
286 | ATSC7m | ATSC (7, ‘m’) |
2D | |
287 | ATSC8m | ATSC (8, ‘m’) |
2D | |
288 | ATSC0v | ATSC (0, ‘v’) |
2D | |
289 | ATSC1v | ATSC (1, ‘v’) |
2D | |
290 | ATSC2v | ATSC (2, ‘v’) |
2D | |
291 | ATSC3v | ATSC (3, ‘v’) |
2D | |
292 | ATSC4v | ATSC (4, ‘v’) |
2D | |
293 | ATSC5v | ATSC (5, ‘v’) |
2D | |
294 | ATSC6v | ATSC (6, ‘v’) |
2D | |
295 | ATSC7v | ATSC (7, ‘v’) |
2D | |
296 | ATSC8v | ATSC (8, ‘v’) |
2D | |
297 | ATSC0se | ATSC (0, ‘se’) |
2D | |
298 | ATSC1se | ATSC (1, ‘se’) |
2D | |
299 | ATSC2se | ATSC (2, ‘se’) |
2D | |
300 | ATSC3se | ATSC (3, ‘se’) |
2D | |
301 | ATSC4se | ATSC (4, ‘se’) |
2D | |
302 | ATSC5se | ATSC (5, ‘se’) |
2D | |
303 | ATSC6se | ATSC (6, ‘se’) |
2D | |
304 | ATSC7se | ATSC (7, ‘se’) |
2D | |
305 | ATSC8se | ATSC (8, ‘se’) |
2D | |
306 | ATSC0pe | ATSC (0, ‘pe’) |
2D | |
307 | ATSC1pe | ATSC (1, ‘pe’) |
2D | |
308 | ATSC2pe | ATSC (2, ‘pe’) |
2D | |
309 | ATSC3pe | ATSC (3, ‘pe’) |
2D | |
310 | ATSC4pe | ATSC (4, ‘pe’) |
2D | |
311 | ATSC5pe | ATSC (5, ‘pe’) |
2D | |
312 | ATSC6pe | ATSC (6, ‘pe’) |
2D | |
313 | ATSC7pe | ATSC (7, ‘pe’) |
2D | |
314 | ATSC8pe | ATSC (8, ‘pe’) |
2D | |
315 | ATSC0are | ATSC (0, ‘are’) |
2D | |
316 | ATSC1are | ATSC (1, ‘are’) |
2D | |
317 | ATSC2are | ATSC (2, ‘are’) |
2D | |
318 | ATSC3are | ATSC (3, ‘are’) |
2D | |
319 | ATSC4are | ATSC (4, ‘are’) |
2D | |
320 | ATSC5are | ATSC (5, ‘are’) |
2D | |
321 | ATSC6are | ATSC (6, ‘are’) |
2D | |
322 | ATSC7are | ATSC (7, ‘are’) |
2D | |
323 | ATSC8are | ATSC (8, ‘are’) |
2D | |
324 | ATSC0p | ATSC (0, ‘p’) |
2D | |
325 | ATSC1p | ATSC (1, ‘p’) |
2D | |
326 | ATSC2p | ATSC (2, ‘p’) |
2D | |
327 | ATSC3p | ATSC (3, ‘p’) |
2D | |
328 | ATSC4p | ATSC (4, ‘p’) |
2D | |
329 | ATSC5p | ATSC (5, ‘p’) |
2D | |
330 | ATSC6p | ATSC (6, ‘p’) |
2D | |
331 | ATSC7p | ATSC (7, ‘p’) |
2D | |
332 | ATSC8p | ATSC (8, ‘p’) |
2D | |
333 | ATSC0i | ATSC (0, ‘i’) |
2D | |
334 | ATSC1i | ATSC (1, ‘i’) |
2D | |
335 | ATSC2i | ATSC (2, ‘i’) |
2D | |
336 | ATSC3i | ATSC (3, ‘i’) |
2D | |
337 | ATSC4i | ATSC (4, ‘i’) |
2D | |
338 | ATSC5i | ATSC (5, ‘i’) |
2D | |
339 | ATSC6i | ATSC (6, ‘i’) |
2D | |
340 | ATSC7i | ATSC (7, ‘i’) |
2D | |
341 | ATSC8i | ATSC (8, ‘i’) |
2D | |
342 | AATSC0c | AATSC (0, ‘c’) |
2D | |
343 | AATSC1c | AATSC (1, ‘c’) |
2D | |
344 | AATSC2c | AATSC (2, ‘c’) |
2D | |
345 | AATSC3c | AATSC (3, ‘c’) |
2D | |
346 | AATSC4c | AATSC (4, ‘c’) |
2D | |
347 | AATSC5c | AATSC (5, ‘c’) |
2D | |
348 | AATSC6c | AATSC (6, ‘c’) |
2D | |
349 | AATSC7c | AATSC (7, ‘c’) |
2D | |
350 | AATSC8c | AATSC (8, ‘c’) |
2D | |
351 | AATSC0dv | AATSC (0, ‘dv’) |
2D | |
352 | AATSC1dv | AATSC (1, ‘dv’) |
2D | |
353 | AATSC2dv | AATSC (2, ‘dv’) |
2D | |
354 | AATSC3dv | AATSC (3, ‘dv’) |
2D | |
355 | AATSC4dv | AATSC (4, ‘dv’) |
2D | |
356 | AATSC5dv | AATSC (5, ‘dv’) |
2D | |
357 | AATSC6dv | AATSC (6, ‘dv’) |
2D | |
358 | AATSC7dv | AATSC (7, ‘dv’) |
2D | |
359 | AATSC8dv | AATSC (8, ‘dv’) |
2D | |
360 | AATSC0d | AATSC (0, ‘d’) |
2D | |
361 | AATSC1d | AATSC (1, ‘d’) |
2D | |
362 | AATSC2d | AATSC (2, ‘d’) |
2D | |
363 | AATSC3d | AATSC (3, ‘d’) |
2D | |
364 | AATSC4d | AATSC (4, ‘d’) |
2D | |
365 | AATSC5d | AATSC (5, ‘d’) |
2D | |
366 | AATSC6d | AATSC (6, ‘d’) |
2D | |
367 | AATSC7d | AATSC (7, ‘d’) |
2D | |
368 | AATSC8d | AATSC (8, ‘d’) |
2D | |
369 | AATSC0s | AATSC (0, ‘s’) |
2D | |
370 | AATSC1s | AATSC (1, ‘s’) |
2D | |
371 | AATSC2s | AATSC (2, ‘s’) |
2D | |
372 | AATSC3s | AATSC (3, ‘s’) |
2D | |
373 | AATSC4s | AATSC (4, ‘s’) |
2D | |
374 | AATSC5s | AATSC (5, ‘s’) |
2D | |
375 | AATSC6s | AATSC (6, ‘s’) |
2D | |
376 | AATSC7s | AATSC (7, ‘s’) |
2D | |
377 | AATSC8s | AATSC (8, ‘s’) |
2D | |
378 | AATSC0Z | AATSC (0, ‘Z’) |
2D | |
379 | AATSC1Z | AATSC (1, ‘Z’) |
2D | |
380 | AATSC2Z | AATSC (2, ‘Z’) |
2D | |
381 | AATSC3Z | AATSC (3, ‘Z’) |
2D | |
382 | AATSC4Z | AATSC (4, ‘Z’) |
2D | |
383 | AATSC5Z | AATSC (5, ‘Z’) |
2D | |
384 | AATSC6Z | AATSC (6, ‘Z’) |
2D | |
385 | AATSC7Z | AATSC (7, ‘Z’) |
2D | |
386 | AATSC8Z | AATSC (8, ‘Z’) |
2D | |
387 | AATSC0m | AATSC (0, ‘m’) |
2D | |
388 | AATSC1m | AATSC (1, ‘m’) |
2D | |
389 | AATSC2m | AATSC (2, ‘m’) |
2D | |
390 | AATSC3m | AATSC (3, ‘m’) |
2D | |
391 | AATSC4m | AATSC (4, ‘m’) |
2D | |
392 | AATSC5m | AATSC (5, ‘m’) |
2D | |
393 | AATSC6m | AATSC (6, ‘m’) |
2D | |
394 | AATSC7m | AATSC (7, ‘m’) |
2D | |
395 | AATSC8m | AATSC (8, ‘m’) |
2D | |
396 | AATSC0v | AATSC (0, ‘v’) |
2D | |
397 | AATSC1v | AATSC (1, ‘v’) |
2D | |
398 | AATSC2v | AATSC (2, ‘v’) |
2D | |
399 | AATSC3v | AATSC (3, ‘v’) |
2D | |
400 | AATSC4v | AATSC (4, ‘v’) |
2D | |
401 | AATSC5v | AATSC (5, ‘v’) |
2D | |
402 | AATSC6v | AATSC (6, ‘v’) |
2D | |
403 | AATSC7v | AATSC (7, ‘v’) |
2D | |
404 | AATSC8v | AATSC (8, ‘v’) |
2D | |
405 | AATSC0se | AATSC (0, ‘se’) |
2D | |
406 | AATSC1se | AATSC (1, ‘se’) |
2D | |
407 | AATSC2se | AATSC (2, ‘se’) |
2D | |
408 | AATSC3se | AATSC (3, ‘se’) |
2D | |
409 | AATSC4se | AATSC (4, ‘se’) |
2D | |
410 | AATSC5se | AATSC (5, ‘se’) |
2D | |
411 | AATSC6se | AATSC (6, ‘se’) |
2D | |
412 | AATSC7se | AATSC (7, ‘se’) |
2D | |
413 | AATSC8se | AATSC (8, ‘se’) |
2D | |
414 | AATSC0pe | AATSC (0, ‘pe’) |
2D | |
415 | AATSC1pe | AATSC (1, ‘pe’) |
2D | |
416 | AATSC2pe | AATSC (2, ‘pe’) |
2D | |
417 | AATSC3pe | AATSC (3, ‘pe’) |
2D | |
418 | AATSC4pe | AATSC (4, ‘pe’) |
2D | |
419 | AATSC5pe | AATSC (5, ‘pe’) |
2D | |
420 | AATSC6pe | AATSC (6, ‘pe’) |
2D | |
421 | AATSC7pe | AATSC (7, ‘pe’) |
2D | |
422 | AATSC8pe | AATSC (8, ‘pe’) |
2D | |
423 | AATSC0are | AATSC (0, ‘are’) |
2D | |
424 | AATSC1are | AATSC (1, ‘are’) |
2D | |
425 | AATSC2are | AATSC (2, ‘are’) |
2D | |
426 | AATSC3are | AATSC (3, ‘are’) |
2D | |
427 | AATSC4are | AATSC (4, ‘are’) |
2D | |
428 | AATSC5are | AATSC (5, ‘are’) |
2D | |
429 | AATSC6are | AATSC (6, ‘are’) |
2D | |
430 | AATSC7are | AATSC (7, ‘are’) |
2D | |
431 | AATSC8are | AATSC (8, ‘are’) |
2D | |
432 | AATSC0p | AATSC (0, ‘p’) |
2D | |
433 | AATSC1p | AATSC (1, ‘p’) |
2D | |
434 | AATSC2p | AATSC (2, ‘p’) |
2D | |
435 | AATSC3p | AATSC (3, ‘p’) |
2D | |
436 | AATSC4p | AATSC (4, ‘p’) |
2D | |
437 | AATSC5p | AATSC (5, ‘p’) |
2D | |
438 | AATSC6p | AATSC (6, ‘p’) |
2D | |
439 | AATSC7p | AATSC (7, ‘p’) |
2D | |
440 | AATSC8p | AATSC (8, ‘p’) |
2D | |
441 | AATSC0i | AATSC (0, ‘i’) |
2D | |
442 | AATSC1i | AATSC (1, ‘i’) |
2D | |
443 | AATSC2i | AATSC (2, ‘i’) |
2D | |
444 | AATSC3i | AATSC (3, ‘i’) |
2D | |
445 | AATSC4i | AATSC (4, ‘i’) |
2D | |
446 | AATSC5i | AATSC (5, ‘i’) |
2D | |
447 | AATSC6i | AATSC (6, ‘i’) |
2D | |
448 | AATSC7i | AATSC (7, ‘i’) |
2D | |
449 | AATSC8i | AATSC (8, ‘i’) |
2D | |
450 | MATS1c | MATS (1, ‘c’) |
2D | |
451 | MATS2c | MATS (2, ‘c’) |
2D | |
452 | MATS3c | MATS (3, ‘c’) |
2D | |
453 | MATS4c | MATS (4, ‘c’) |
2D | |
454 | MATS5c | MATS (5, ‘c’) |
2D | |
455 | MATS6c | MATS (6, ‘c’) |
2D | |
456 | MATS7c | MATS (7, ‘c’) |
2D | |
457 | MATS8c | MATS (8, ‘c’) |
2D | |
458 | MATS1dv | MATS (1, ‘dv’) |
2D | |
459 | MATS2dv | MATS (2, ‘dv’) |
2D | |
460 | MATS3dv | MATS (3, ‘dv’) |
2D | |
461 | MATS4dv | MATS (4, ‘dv’) |
2D | |
462 | MATS5dv | MATS (5, ‘dv’) |
2D | |
463 | MATS6dv | MATS (6, ‘dv’) |
2D | |
464 | MATS7dv | MATS (7, ‘dv’) |
2D | |
465 | MATS8dv | MATS (8, ‘dv’) |
2D | |
466 | MATS1d | MATS (1, ‘d’) |
2D | |
467 | MATS2d | MATS (2, ‘d’) |
2D | |
468 | MATS3d | MATS (3, ‘d’) |
2D | |
469 | MATS4d | MATS (4, ‘d’) |
2D | |
470 | MATS5d | MATS (5, ‘d’) |
2D | |
471 | MATS6d | MATS (6, ‘d’) |
2D | |
472 | MATS7d | MATS (7, ‘d’) |
2D | |
473 | MATS8d | MATS (8, ‘d’) |
2D | |
474 | MATS1s | MATS (1, ‘s’) |
2D | |
475 | MATS2s | MATS (2, ‘s’) |
2D | |
476 | MATS3s | MATS (3, ‘s’) |
2D | |
477 | MATS4s | MATS (4, ‘s’) |
2D | |
478 | MATS5s | MATS (5, ‘s’) |
2D | |
479 | MATS6s | MATS (6, ‘s’) |
2D | |
480 | MATS7s | MATS (7, ‘s’) |
2D | |
481 | MATS8s | MATS (8, ‘s’) |
2D | |
482 | MATS1Z | MATS (1, ‘Z’) |
2D | |
483 | MATS2Z | MATS (2, ‘Z’) |
2D | |
484 | MATS3Z | MATS (3, ‘Z’) |
2D | |
485 | MATS4Z | MATS (4, ‘Z’) |
2D | |
486 | MATS5Z | MATS (5, ‘Z’) |
2D | |
487 | MATS6Z | MATS (6, ‘Z’) |
2D | |
488 | MATS7Z | MATS (7, ‘Z’) |
2D | |
489 | MATS8Z | MATS (8, ‘Z’) |
2D | |
490 | MATS1m | MATS (1, ‘m’) |
2D | |
491 | MATS2m | MATS (2, ‘m’) |
2D | |
492 | MATS3m | MATS (3, ‘m’) |
2D | |
493 | MATS4m | MATS (4, ‘m’) |
2D | |
494 | MATS5m | MATS (5, ‘m’) |
2D | |
495 | MATS6m | MATS (6, ‘m’) |
2D | |
496 | MATS7m | MATS (7, ‘m’) |
2D | |
497 | MATS8m | MATS (8, ‘m’) |
2D | |
498 | MATS1v | MATS (1, ‘v’) |
2D | |
499 | MATS2v | MATS (2, ‘v’) |
2D | |
500 | MATS3v | MATS (3, ‘v’) |
2D | |
501 | MATS4v | MATS (4, ‘v’) |
2D | |
502 | MATS5v | MATS (5, ‘v’) |
2D | |
503 | MATS6v | MATS (6, ‘v’) |
2D | |
504 | MATS7v | MATS (7, ‘v’) |
2D | |
505 | MATS8v | MATS (8, ‘v’) |
2D | |
506 | MATS1se | MATS (1, ‘se’) |
2D | |
507 | MATS2se | MATS (2, ‘se’) |
2D | |
508 | MATS3se | MATS (3, ‘se’) |
2D | |
509 | MATS4se | MATS (4, ‘se’) |
2D | |
510 | MATS5se | MATS (5, ‘se’) |
2D | |
511 | MATS6se | MATS (6, ‘se’) |
2D | |
512 | MATS7se | MATS (7, ‘se’) |
2D | |
513 | MATS8se | MATS (8, ‘se’) |
2D | |
514 | MATS1pe | MATS (1, ‘pe’) |
2D | |
515 | MATS2pe | MATS (2, ‘pe’) |
2D | |
516 | MATS3pe | MATS (3, ‘pe’) |
2D | |
517 | MATS4pe | MATS (4, ‘pe’) |
2D | |
518 | MATS5pe | MATS (5, ‘pe’) |
2D | |
519 | MATS6pe | MATS (6, ‘pe’) |
2D | |
520 | MATS7pe | MATS (7, ‘pe’) |
2D | |
521 | MATS8pe | MATS (8, ‘pe’) |
2D | |
522 | MATS1are | MATS (1, ‘are’) |
2D | |
523 | MATS2are | MATS (2, ‘are’) |
2D | |
524 | MATS3are | MATS (3, ‘are’) |
2D | |
525 | MATS4are | MATS (4, ‘are’) |
2D | |
526 | MATS5are | MATS (5, ‘are’) |
2D | |
527 | MATS6are | MATS (6, ‘are’) |
2D | |
528 | MATS7are | MATS (7, ‘are’) |
2D | |
529 | MATS8are | MATS (8, ‘are’) |
2D | |
530 | MATS1p | MATS (1, ‘p’) |
2D | |
531 | MATS2p | MATS (2, ‘p’) |
2D | |
532 | MATS3p | MATS (3, ‘p’) |
2D | |
533 | MATS4p | MATS (4, ‘p’) |
2D | |
534 | MATS5p | MATS (5, ‘p’) |
2D | |
535 | MATS6p | MATS (6, ‘p’) |
2D | |
536 | MATS7p | MATS (7, ‘p’) |
2D | |
537 | MATS8p | MATS (8, ‘p’) |
2D | |
538 | MATS1i | MATS (1, ‘i’) |
2D | |
539 | MATS2i | MATS (2, ‘i’) |
2D | |
540 | MATS3i | MATS (3, ‘i’) |
2D | |
541 | MATS4i | MATS (4, ‘i’) |
2D | |
542 | MATS5i | MATS (5, ‘i’) |
2D | |
543 | MATS6i | MATS (6, ‘i’) |
2D | |
544 | MATS7i | MATS (7, ‘i’) |
2D | |
545 | MATS8i | MATS (8, ‘i’) |
2D | |
546 | GATS1c | GATS (1, ‘c’) |
2D | |
547 | GATS2c | GATS (2, ‘c’) |
2D | |
548 | GATS3c | GATS (3, ‘c’) |
2D | |
549 | GATS4c | GATS (4, ‘c’) |
2D | |
550 | GATS5c | GATS (5, ‘c’) |
2D | |
551 | GATS6c | GATS (6, ‘c’) |
2D | |
552 | GATS7c | GATS (7, ‘c’) |
2D | |
553 | GATS8c | GATS (8, ‘c’) |
2D | |
554 | GATS1dv | GATS (1, ‘dv’) |
2D | |
555 | GATS2dv | GATS (2, ‘dv’) |
2D | |
556 | GATS3dv | GATS (3, ‘dv’) |
2D | |
557 | GATS4dv | GATS (4, ‘dv’) |
2D | |
558 | GATS5dv | GATS (5, ‘dv’) |
2D | |
559 | GATS6dv | GATS (6, ‘dv’) |
2D | |
560 | GATS7dv | GATS (7, ‘dv’) |
2D | |
561 | GATS8dv | GATS (8, ‘dv’) |
2D | |
562 | GATS1d | GATS (1, ‘d’) |
2D | |
563 | GATS2d | GATS (2, ‘d’) |
2D | |
564 | GATS3d | GATS (3, ‘d’) |
2D | |
565 | GATS4d | GATS (4, ‘d’) |
2D | |
566 | GATS5d | GATS (5, ‘d’) |
2D | |
567 | GATS6d | GATS (6, ‘d’) |
2D | |
568 | GATS7d | GATS (7, ‘d’) |
2D | |
569 | GATS8d | GATS (8, ‘d’) |
2D | |
570 | GATS1s | GATS (1, ‘s’) |
2D | |
571 | GATS2s | GATS (2, ‘s’) |
2D | |
572 | GATS3s | GATS (3, ‘s’) |
2D | |
573 | GATS4s | GATS (4, ‘s’) |
2D | |
574 | GATS5s | GATS (5, ‘s’) |
2D | |
575 | GATS6s | GATS (6, ‘s’) |
2D | |
576 | GATS7s | GATS (7, ‘s’) |
2D | |
577 | GATS8s | GATS (8, ‘s’) |
2D | |
578 | GATS1Z | GATS (1, ‘Z’) |
2D | |
579 | GATS2Z | GATS (2, ‘Z’) |
2D | |
580 | GATS3Z | GATS (3, ‘Z’) |
2D | |
581 | GATS4Z | GATS (4, ‘Z’) |
2D | |
582 | GATS5Z | GATS (5, ‘Z’) |
2D | |
583 | GATS6Z | GATS (6, ‘Z’) |
2D | |
584 | GATS7Z | GATS (7, ‘Z’) |
2D | |
585 | GATS8Z | GATS (8, ‘Z’) |
2D | |
586 | GATS1m | GATS (1, ‘m’) |
2D | |
587 | GATS2m | GATS (2, ‘m’) |
2D | |
588 | GATS3m | GATS (3, ‘m’) |
2D | |
589 | GATS4m | GATS (4, ‘m’) |
2D | |
590 | GATS5m | GATS (5, ‘m’) |
2D | |
591 | GATS6m | GATS (6, ‘m’) |
2D | |
592 | GATS7m | GATS (7, ‘m’) |
2D | |
593 | GATS8m | GATS (8, ‘m’) |
2D | |
594 | GATS1v | GATS (1, ‘v’) |
2D | |
595 | GATS2v | GATS (2, ‘v’) |
2D | |
596 | GATS3v | GATS (3, ‘v’) |
2D | |
597 | GATS4v | GATS (4, ‘v’) |
2D | |
598 | GATS5v | GATS (5, ‘v’) |
2D | |
599 | GATS6v | GATS (6, ‘v’) |
2D | |
600 | GATS7v | GATS (7, ‘v’) |
2D | |
601 | GATS8v | GATS (8, ‘v’) |
2D | |
602 | GATS1se | GATS (1, ‘se’) |
2D | |
603 | GATS2se | GATS (2, ‘se’) |
2D | |
604 | GATS3se | GATS (3, ‘se’) |
2D | |
605 | GATS4se | GATS (4, ‘se’) |
2D | |
606 | GATS5se | GATS (5, ‘se’) |
2D | |
607 | GATS6se | GATS (6, ‘se’) |
2D | |
608 | GATS7se | GATS (7, ‘se’) |
2D | |
609 | GATS8se | GATS (8, ‘se’) |
2D | |
610 | GATS1pe | GATS (1, ‘pe’) |
2D | |
611 | GATS2pe | GATS (2, ‘pe’) |
2D | |
612 | GATS3pe | GATS (3, ‘pe’) |
2D | |
613 | GATS4pe | GATS (4, ‘pe’) |
2D | |
614 | GATS5pe | GATS (5, ‘pe’) |
2D | |
615 | GATS6pe | GATS (6, ‘pe’) |
2D | |
616 | GATS7pe | GATS (7, ‘pe’) |
2D | |
617 | GATS8pe | GATS (8, ‘pe’) |
2D | |
618 | GATS1are | GATS (1, ‘are’) |
2D | |
619 | GATS2are | GATS (2, ‘are’) |
2D | |
620 | GATS3are | GATS (3, ‘are’) |
2D | |
621 | GATS4are | GATS (4, ‘are’) |
2D | |
622 | GATS5are | GATS (5, ‘are’) |
2D | |
623 | GATS6are | GATS (6, ‘are’) |
2D | |
624 | GATS7are | GATS (7, ‘are’) |
2D | |
625 | GATS8are | GATS (8, ‘are’) |
2D | |
626 | GATS1p | GATS (1, ‘p’) |
2D | |
627 | GATS2p | GATS (2, ‘p’) |
2D | |
628 | GATS3p | GATS (3, ‘p’) |
2D | |
629 | GATS4p | GATS (4, ‘p’) |
2D | |
630 | GATS5p | GATS (5, ‘p’) |
2D | |
631 | GATS6p | GATS (6, ‘p’) |
2D | |
632 | GATS7p | GATS (7, ‘p’) |
2D | |
633 | GATS8p | GATS (8, ‘p’) |
2D | |
634 | GATS1i | GATS (1, ‘i’) |
2D | |
635 | GATS2i | GATS (2, ‘i’) |
2D | |
636 | GATS3i | GATS (3, ‘i’) |
2D | |
637 | GATS4i | GATS (4, ‘i’) |
2D | |
638 | GATS5i | GATS (5, ‘i’) |
2D | |
639 | GATS6i | GATS (6, ‘i’) |
2D | |
640 | GATS7i | GATS (7, ‘i’) |
2D | |
641 | GATS8i | GATS (8, ‘i’) |
2D | |
642 | BCUT |
BCUTc-1h | BCUT (‘c’, 0) |
2D |
643 | BCUTc-1l | BCUT (‘c’, -1) |
2D | |
644 | BCUTdv-1h | BCUT (‘dv’, 0) |
2D | |
645 | BCUTdv-1l | BCUT (‘dv’, -1) |
2D | |
646 | BCUTd-1h | BCUT (‘d’, 0) |
2D | |
647 | BCUTd-1l | BCUT (‘d’, -1) |
2D | |
648 | BCUTs-1h | BCUT (‘s’, 0) |
2D | |
649 | BCUTs-1l | BCUT (‘s’, -1) |
2D | |
650 | BCUTZ-1h | BCUT (‘Z’, 0) |
2D | |
651 | BCUTZ-1l | BCUT (‘Z’, -1) |
2D | |
652 | BCUTm-1h | BCUT (‘m’, 0) |
2D | |
653 | BCUTm-1l | BCUT (‘m’, -1) |
2D | |
654 | BCUTv-1h | BCUT (‘v’, 0) |
2D | |
655 | BCUTv-1l | BCUT (‘v’, -1) |
2D | |
656 | BCUTse-1h | BCUT (‘se’, 0) |
2D | |
657 | BCUTse-1l | BCUT (‘se’, -1) |
2D | |
658 | BCUTpe-1h | BCUT (‘pe’, 0) |
2D | |
659 | BCUTpe-1l | BCUT (‘pe’, -1) |
2D | |
660 | BCUTare-1h | BCUT (‘are’, 0) |
2D | |
661 | BCUTare-1l | BCUT (‘are’, -1) |
2D | |
662 | BCUTp-1h | BCUT (‘p’, 0) |
2D | |
663 | BCUTp-1l | BCUT (‘p’, -1) |
2D | |
664 | BCUTi-1h | BCUT (‘i’, 0) |
2D | |
665 | BCUTi-1l | BCUT (‘i’, -1) |
2D | |
666 | BalabanJ |
BalabanJ | BalabanJ () |
2D |
667 | BaryszMatrix |
SpAbs_DzZ | BaryszMatrix (‘Z’, ‘SpAbs’) |
2D |
668 | SpMax_DzZ | BaryszMatrix (‘Z’, ‘SpMax’) |
2D | |
669 | SpDiam_DzZ | BaryszMatrix (‘Z’, ‘SpDiam’) |
2D | |
670 | SpAD_DzZ | BaryszMatrix (‘Z’, ‘SpAD’) |
2D | |
671 | SpMAD_DzZ | BaryszMatrix (‘Z’, ‘SpMAD’) |
2D | |
672 | LogEE_DzZ | BaryszMatrix (‘Z’, ‘LogEE’) |
2D | |
673 | SM1_DzZ | BaryszMatrix (‘Z’, ‘SM1’) |
2D | |
674 | VE1_DzZ | BaryszMatrix (‘Z’, ‘VE1’) |
2D | |
675 | VE2_DzZ | BaryszMatrix (‘Z’, ‘VE2’) |
2D | |
676 | VE3_DzZ | BaryszMatrix (‘Z’, ‘VE3’) |
2D | |
677 | VR1_DzZ | BaryszMatrix (‘Z’, ‘VR1’) |
2D | |
678 | VR2_DzZ | BaryszMatrix (‘Z’, ‘VR2’) |
2D | |
679 | VR3_DzZ | BaryszMatrix (‘Z’, ‘VR3’) |
2D | |
680 | SpAbs_Dzm | BaryszMatrix (‘m’, ‘SpAbs’) |
2D | |
681 | SpMax_Dzm | BaryszMatrix (‘m’, ‘SpMax’) |
2D | |
682 | SpDiam_Dzm | BaryszMatrix (‘m’, ‘SpDiam’) |
2D | |
683 | SpAD_Dzm | BaryszMatrix (‘m’, ‘SpAD’) |
2D | |
684 | SpMAD_Dzm | BaryszMatrix (‘m’, ‘SpMAD’) |
2D | |
685 | LogEE_Dzm | BaryszMatrix (‘m’, ‘LogEE’) |
2D | |
686 | SM1_Dzm | BaryszMatrix (‘m’, ‘SM1’) |
2D | |
687 | VE1_Dzm | BaryszMatrix (‘m’, ‘VE1’) |
2D | |
688 | VE2_Dzm | BaryszMatrix (‘m’, ‘VE2’) |
2D | |
689 | VE3_Dzm | BaryszMatrix (‘m’, ‘VE3’) |
2D | |
690 | VR1_Dzm | BaryszMatrix (‘m’, ‘VR1’) |
2D | |
691 | VR2_Dzm | BaryszMatrix (‘m’, ‘VR2’) |
2D | |
692 | VR3_Dzm | BaryszMatrix (‘m’, ‘VR3’) |
2D | |
693 | SpAbs_Dzv | BaryszMatrix (‘v’, ‘SpAbs’) |
2D | |
694 | SpMax_Dzv | BaryszMatrix (‘v’, ‘SpMax’) |
2D | |
695 | SpDiam_Dzv | BaryszMatrix (‘v’, ‘SpDiam’) |
2D | |
696 | SpAD_Dzv | BaryszMatrix (‘v’, ‘SpAD’) |
2D | |
697 | SpMAD_Dzv | BaryszMatrix (‘v’, ‘SpMAD’) |
2D | |
698 | LogEE_Dzv | BaryszMatrix (‘v’, ‘LogEE’) |
2D | |
699 | SM1_Dzv | BaryszMatrix (‘v’, ‘SM1’) |
2D | |
700 | VE1_Dzv | BaryszMatrix (‘v’, ‘VE1’) |
2D | |
701 | VE2_Dzv | BaryszMatrix (‘v’, ‘VE2’) |
2D | |
702 | VE3_Dzv | BaryszMatrix (‘v’, ‘VE3’) |
2D | |
703 | VR1_Dzv | BaryszMatrix (‘v’, ‘VR1’) |
2D | |
704 | VR2_Dzv | BaryszMatrix (‘v’, ‘VR2’) |
2D | |
705 | VR3_Dzv | BaryszMatrix (‘v’, ‘VR3’) |
2D | |
706 | SpAbs_Dzse | BaryszMatrix (‘se’, ‘SpAbs’) |
2D | |
707 | SpMax_Dzse | BaryszMatrix (‘se’, ‘SpMax’) |
2D | |
708 | SpDiam_Dzse | BaryszMatrix (‘se’, ‘SpDiam’) |
2D | |
709 | SpAD_Dzse | BaryszMatrix (‘se’, ‘SpAD’) |
2D | |
710 | SpMAD_Dzse | BaryszMatrix (‘se’, ‘SpMAD’) |
2D | |
711 | LogEE_Dzse | BaryszMatrix (‘se’, ‘LogEE’) |
2D | |
712 | SM1_Dzse | BaryszMatrix (‘se’, ‘SM1’) |
2D | |
713 | VE1_Dzse | BaryszMatrix (‘se’, ‘VE1’) |
2D | |
714 | VE2_Dzse | BaryszMatrix (‘se’, ‘VE2’) |
2D | |
715 | VE3_Dzse | BaryszMatrix (‘se’, ‘VE3’) |
2D | |
716 | VR1_Dzse | BaryszMatrix (‘se’, ‘VR1’) |
2D | |
717 | VR2_Dzse | BaryszMatrix (‘se’, ‘VR2’) |
2D | |
718 | VR3_Dzse | BaryszMatrix (‘se’, ‘VR3’) |
2D | |
719 | SpAbs_Dzpe | BaryszMatrix (‘pe’, ‘SpAbs’) |
2D | |
720 | SpMax_Dzpe | BaryszMatrix (‘pe’, ‘SpMax’) |
2D | |
721 | SpDiam_Dzpe | BaryszMatrix (‘pe’, ‘SpDiam’) |
2D | |
722 | SpAD_Dzpe | BaryszMatrix (‘pe’, ‘SpAD’) |
2D | |
723 | SpMAD_Dzpe | BaryszMatrix (‘pe’, ‘SpMAD’) |
2D | |
724 | LogEE_Dzpe | BaryszMatrix (‘pe’, ‘LogEE’) |
2D | |
725 | SM1_Dzpe | BaryszMatrix (‘pe’, ‘SM1’) |
2D | |
726 | VE1_Dzpe | BaryszMatrix (‘pe’, ‘VE1’) |
2D | |
727 | VE2_Dzpe | BaryszMatrix (‘pe’, ‘VE2’) |
2D | |
728 | VE3_Dzpe | BaryszMatrix (‘pe’, ‘VE3’) |
2D | |
729 | VR1_Dzpe | BaryszMatrix (‘pe’, ‘VR1’) |
2D | |
730 | VR2_Dzpe | BaryszMatrix (‘pe’, ‘VR2’) |
2D | |
731 | VR3_Dzpe | BaryszMatrix (‘pe’, ‘VR3’) |
2D | |
732 | SpAbs_Dzare | BaryszMatrix (‘are’, ‘SpAbs’) |
2D | |
733 | SpMax_Dzare | BaryszMatrix (‘are’, ‘SpMax’) |
2D | |
734 | SpDiam_Dzare | BaryszMatrix (‘are’, ‘SpDiam’) |
2D | |
735 | SpAD_Dzare | BaryszMatrix (‘are’, ‘SpAD’) |
2D | |
736 | SpMAD_Dzare | BaryszMatrix (‘are’, ‘SpMAD’) |
2D | |
737 | LogEE_Dzare | BaryszMatrix (‘are’, ‘LogEE’) |
2D | |
738 | SM1_Dzare | BaryszMatrix (‘are’, ‘SM1’) |
2D | |
739 | VE1_Dzare | BaryszMatrix (‘are’, ‘VE1’) |
2D | |
740 | VE2_Dzare | BaryszMatrix (‘are’, ‘VE2’) |
2D | |
741 | VE3_Dzare | BaryszMatrix (‘are’, ‘VE3’) |
2D | |
742 | VR1_Dzare | BaryszMatrix (‘are’, ‘VR1’) |
2D | |
743 | VR2_Dzare | BaryszMatrix (‘are’, ‘VR2’) |
2D | |
744 | VR3_Dzare | BaryszMatrix (‘are’, ‘VR3’) |
2D | |
745 | SpAbs_Dzp | BaryszMatrix (‘p’, ‘SpAbs’) |
2D | |
746 | SpMax_Dzp | BaryszMatrix (‘p’, ‘SpMax’) |
2D | |
747 | SpDiam_Dzp | BaryszMatrix (‘p’, ‘SpDiam’) |
2D | |
748 | SpAD_Dzp | BaryszMatrix (‘p’, ‘SpAD’) |
2D | |
749 | SpMAD_Dzp | BaryszMatrix (‘p’, ‘SpMAD’) |
2D | |
750 | LogEE_Dzp | BaryszMatrix (‘p’, ‘LogEE’) |
2D | |
751 | SM1_Dzp | BaryszMatrix (‘p’, ‘SM1’) |
2D | |
752 | VE1_Dzp | BaryszMatrix (‘p’, ‘VE1’) |
2D | |
753 | VE2_Dzp | BaryszMatrix (‘p’, ‘VE2’) |
2D | |
754 | VE3_Dzp | BaryszMatrix (‘p’, ‘VE3’) |
2D | |
755 | VR1_Dzp | BaryszMatrix (‘p’, ‘VR1’) |
2D | |
756 | VR2_Dzp | BaryszMatrix (‘p’, ‘VR2’) |
2D | |
757 | VR3_Dzp | BaryszMatrix (‘p’, ‘VR3’) |
2D | |
758 | SpAbs_Dzi | BaryszMatrix (‘i’, ‘SpAbs’) |
2D | |
759 | SpMax_Dzi | BaryszMatrix (‘i’, ‘SpMax’) |
2D | |
760 | SpDiam_Dzi | BaryszMatrix (‘i’, ‘SpDiam’) |
2D | |
761 | SpAD_Dzi | BaryszMatrix (‘i’, ‘SpAD’) |
2D | |
762 | SpMAD_Dzi | BaryszMatrix (‘i’, ‘SpMAD’) |
2D | |
763 | LogEE_Dzi | BaryszMatrix (‘i’, ‘LogEE’) |
2D | |
764 | SM1_Dzi | BaryszMatrix (‘i’, ‘SM1’) |
2D | |
765 | VE1_Dzi | BaryszMatrix (‘i’, ‘VE1’) |
2D | |
766 | VE2_Dzi | BaryszMatrix (‘i’, ‘VE2’) |
2D | |
767 | VE3_Dzi | BaryszMatrix (‘i’, ‘VE3’) |
2D | |
768 | VR1_Dzi | BaryszMatrix (‘i’, ‘VR1’) |
2D | |
769 | VR2_Dzi | BaryszMatrix (‘i’, ‘VR2’) |
2D | |
770 | VR3_Dzi | BaryszMatrix (‘i’, ‘VR3’) |
2D | |
771 | BertzCT |
BertzCT | BertzCT () |
2D |
772 | BondCount |
nBonds | BondCount (‘any’, False) |
2D |
773 | nBondsO | BondCount (‘heavy’, False) |
2D | |
774 | nBondsS | BondCount (‘single’, False) |
2D | |
775 | nBondsD | BondCount (‘double’, False) |
2D | |
776 | nBondsT | BondCount (‘triple’, False) |
2D | |
777 | nBondsA | BondCount (‘aromatic’, False) |
2D | |
778 | nBondsM | BondCount (‘multiple’, False) |
2D | |
779 | nBondsKS | BondCount (‘single’, True) |
2D | |
780 | nBondsKD | BondCount (‘double’, True) |
2D | |
781 | CPSA |
PNSA1 | PNSA (1) |
3D |
782 | PNSA2 | PNSA (2) |
3D | |
783 | PNSA3 | PNSA (3) |
3D | |
784 | PNSA4 | PNSA (4) |
3D | |
785 | PNSA5 | PNSA (5) |
3D | |
786 | PPSA1 | PPSA (1) |
3D | |
787 | PPSA2 | PPSA (2) |
3D | |
788 | PPSA3 | PPSA (3) |
3D | |
789 | PPSA4 | PPSA (4) |
3D | |
790 | PPSA5 | PPSA (5) |
3D | |
791 | DPSA1 | DPSA (1) |
3D | |
792 | DPSA2 | DPSA (2) |
3D | |
793 | DPSA3 | DPSA (3) |
3D | |
794 | DPSA4 | DPSA (4) |
3D | |
795 | DPSA5 | DPSA (5) |
3D | |
796 | FNSA1 | FNSA (1) |
3D | |
797 | FNSA2 | FNSA (2) |
3D | |
798 | FNSA3 | FNSA (3) |
3D | |
799 | FNSA4 | FNSA (4) |
3D | |
800 | FNSA5 | FNSA (5) |
3D | |
801 | FPSA1 | FPSA (1) |
3D | |
802 | FPSA2 | FPSA (2) |
3D | |
803 | FPSA3 | FPSA (3) |
3D | |
804 | FPSA4 | FPSA (4) |
3D | |
805 | FPSA5 | FPSA (5) |
3D | |
806 | WNSA1 | WNSA (1) |
3D | |
807 | WNSA2 | WNSA (2) |
3D | |
808 | WNSA3 | WNSA (3) |
3D | |
809 | WNSA4 | WNSA (4) |
3D | |
810 | WNSA5 | WNSA (5) |
3D | |
811 | WPSA1 | WPSA (1) |
3D | |
812 | WPSA2 | WPSA (2) |
3D | |
813 | WPSA3 | WPSA (3) |
3D | |
814 | WPSA4 | WPSA (4) |
3D | |
815 | WPSA5 | WPSA (5) |
3D | |
816 | RNCG | RNCG () |
2D | |
817 | RPCG | RPCG () |
2D | |
818 | RNCS | RNCS () |
3D | |
819 | RPCS | RPCS () |
3D | |
820 | TASA | TASA () |
3D | |
821 | TPSA | TPSA () |
3D | |
822 | RASA | RASA () |
3D | |
823 | RPSA | RPSA () |
3D | |
824 | CarbonTypes |
C1SP1 | CarbonTypes (1, 1) |
2D |
825 | C2SP1 | CarbonTypes (2, 1) |
2D | |
826 | C1SP2 | CarbonTypes (1, 2) |
2D | |
827 | C2SP2 | CarbonTypes (2, 2) |
2D | |
828 | C3SP2 | CarbonTypes (3, 2) |
2D | |
829 | C1SP3 | CarbonTypes (1, 3) |
2D | |
830 | C2SP3 | CarbonTypes (2, 3) |
2D | |
831 | C3SP3 | CarbonTypes (3, 3) |
2D | |
832 | C4SP3 | CarbonTypes (4, 3) |
2D | |
833 | HybRatio | HybridizationRatio () |
2D | |
834 | Chi |
Xch-3d | Chi (‘chain’, 3, ‘d’, False) |
2D |
835 | Xch-4d | Chi (‘chain’, 4, ‘d’, False) |
2D | |
836 | Xch-5d | Chi (‘chain’, 5, ‘d’, False) |
2D | |
837 | Xch-6d | Chi (‘chain’, 6, ‘d’, False) |
2D | |
838 | Xch-7d | Chi (‘chain’, 7, ‘d’, False) |
2D | |
839 | Xch-3dv | Chi (‘chain’, 3, ‘dv’, False) |
2D | |
840 | Xch-4dv | Chi (‘chain’, 4, ‘dv’, False) |
2D | |
841 | Xch-5dv | Chi (‘chain’, 5, ‘dv’, False) |
2D | |
842 | Xch-6dv | Chi (‘chain’, 6, ‘dv’, False) |
2D | |
843 | Xch-7dv | Chi (‘chain’, 7, ‘dv’, False) |
2D | |
844 | Xc-3d | Chi (‘cluster’, 3, ‘d’, False) |
2D | |
845 | Xc-4d | Chi (‘cluster’, 4, ‘d’, False) |
2D | |
846 | Xc-5d | Chi (‘cluster’, 5, ‘d’, False) |
2D | |
847 | Xc-6d | Chi (‘cluster’, 6, ‘d’, False) |
2D | |
848 | Xc-3dv | Chi (‘cluster’, 3, ‘dv’, False) |
2D | |
849 | Xc-4dv | Chi (‘cluster’, 4, ‘dv’, False) |
2D | |
850 | Xc-5dv | Chi (‘cluster’, 5, ‘dv’, False) |
2D | |
851 | Xc-6dv | Chi (‘cluster’, 6, ‘dv’, False) |
2D | |
852 | Xpc-4d | Chi (‘path_cluster’, 4, ‘d’, False) |
2D | |
853 | Xpc-5d | Chi (‘path_cluster’, 5, ‘d’, False) |
2D | |
854 | Xpc-6d | Chi (‘path_cluster’, 6, ‘d’, False) |
2D | |
855 | Xpc-4dv | Chi (‘path_cluster’, 4, ‘dv’, False) |
2D | |
856 | Xpc-5dv | Chi (‘path_cluster’, 5, ‘dv’, False) |
2D | |
857 | Xpc-6dv | Chi (‘path_cluster’, 6, ‘dv’, False) |
2D | |
858 | Xp-0d | Chi (‘path’, 0, ‘d’, False) |
2D | |
859 | Xp-1d | Chi (‘path’, 1, ‘d’, False) |
2D | |
860 | Xp-2d | Chi (‘path’, 2, ‘d’, False) |
2D | |
861 | Xp-3d | Chi (‘path’, 3, ‘d’, False) |
2D | |
862 | Xp-4d | Chi (‘path’, 4, ‘d’, False) |
2D | |
863 | Xp-5d | Chi (‘path’, 5, ‘d’, False) |
2D | |
864 | Xp-6d | Chi (‘path’, 6, ‘d’, False) |
2D | |
865 | Xp-7d | Chi (‘path’, 7, ‘d’, False) |
2D | |
866 | AXp-0d | Chi (‘path’, 0, ‘d’, True) |
2D | |
867 | AXp-1d | Chi (‘path’, 1, ‘d’, True) |
2D | |
868 | AXp-2d | Chi (‘path’, 2, ‘d’, True) |
2D | |
869 | AXp-3d | Chi (‘path’, 3, ‘d’, True) |
2D | |
870 | AXp-4d | Chi (‘path’, 4, ‘d’, True) |
2D | |
871 | AXp-5d | Chi (‘path’, 5, ‘d’, True) |
2D | |
872 | AXp-6d | Chi (‘path’, 6, ‘d’, True) |
2D | |
873 | AXp-7d | Chi (‘path’, 7, ‘d’, True) |
2D | |
874 | Xp-0dv | Chi (‘path’, 0, ‘dv’, False) |
2D | |
875 | Xp-1dv | Chi (‘path’, 1, ‘dv’, False) |
2D | |
876 | Xp-2dv | Chi (‘path’, 2, ‘dv’, False) |
2D | |
877 | Xp-3dv | Chi (‘path’, 3, ‘dv’, False) |
2D | |
878 | Xp-4dv | Chi (‘path’, 4, ‘dv’, False) |
2D | |
879 | Xp-5dv | Chi (‘path’, 5, ‘dv’, False) |
2D | |
880 | Xp-6dv | Chi (‘path’, 6, ‘dv’, False) |
2D | |
881 | Xp-7dv | Chi (‘path’, 7, ‘dv’, False) |
2D | |
882 | AXp-0dv | Chi (‘path’, 0, ‘dv’, True) |
2D | |
883 | AXp-1dv | Chi (‘path’, 1, ‘dv’, True) |
2D | |
884 | AXp-2dv | Chi (‘path’, 2, ‘dv’, True) |
2D | |
885 | AXp-3dv | Chi (‘path’, 3, ‘dv’, True) |
2D | |
886 | AXp-4dv | Chi (‘path’, 4, ‘dv’, True) |
2D | |
887 | AXp-5dv | Chi (‘path’, 5, ‘dv’, True) |
2D | |
888 | AXp-6dv | Chi (‘path’, 6, ‘dv’, True) |
2D | |
889 | AXp-7dv | Chi (‘path’, 7, ‘dv’, True) |
2D | |
890 | Constitutional |
SZ | ConstitutionalSum (‘Z’) |
2D |
891 | Sm | ConstitutionalSum (‘m’) |
2D | |
892 | Sv | ConstitutionalSum (‘v’) |
2D | |
893 | Sse | ConstitutionalSum (‘se’) |
2D | |
894 | Spe | ConstitutionalSum (‘pe’) |
2D | |
895 | Sare | ConstitutionalSum (‘are’) |
2D | |
896 | Sp | ConstitutionalSum (‘p’) |
2D | |
897 | Si | ConstitutionalSum (‘i’) |
2D | |
898 | MZ | ConstitutionalMean (‘Z’) |
2D | |
899 | Mm | ConstitutionalMean (‘m’) |
2D | |
900 | Mv | ConstitutionalMean (‘v’) |
2D | |
901 | Mse | ConstitutionalMean (‘se’) |
2D | |
902 | Mpe | ConstitutionalMean (‘pe’) |
2D | |
903 | Mare | ConstitutionalMean (‘are’) |
2D | |
904 | Mp | ConstitutionalMean (‘p’) |
2D | |
905 | Mi | ConstitutionalMean (‘i’) |
2D | |
906 | DetourMatrix |
SpAbs_Dt | DetourMatrix (‘SpAbs’) |
2D |
907 | SpMax_Dt | DetourMatrix (‘SpMax’) |
2D | |
908 | SpDiam_Dt | DetourMatrix (‘SpDiam’) |
2D | |
909 | SpAD_Dt | DetourMatrix (‘SpAD’) |
2D | |
910 | SpMAD_Dt | DetourMatrix (‘SpMAD’) |
2D | |
911 | LogEE_Dt | DetourMatrix (‘LogEE’) |
2D | |
912 | SM1_Dt | DetourMatrix (‘SM1’) |
2D | |
913 | VE1_Dt | DetourMatrix (‘VE1’) |
2D | |
914 | VE2_Dt | DetourMatrix (‘VE2’) |
2D | |
915 | VE3_Dt | DetourMatrix (‘VE3’) |
2D | |
916 | VR1_Dt | DetourMatrix (‘VR1’) |
2D | |
917 | VR2_Dt | DetourMatrix (‘VR2’) |
2D | |
918 | VR3_Dt | DetourMatrix (‘VR3’) |
2D | |
919 | DetourIndex | DetourIndex () |
2D | |
920 | DistanceMatrix |
SpAbs_D | DistanceMatrix (‘SpAbs’) |
2D |
921 | SpMax_D | DistanceMatrix (‘SpMax’) |
2D | |
922 | SpDiam_D | DistanceMatrix (‘SpDiam’) |
2D | |
923 | SpAD_D | DistanceMatrix (‘SpAD’) |
2D | |
924 | SpMAD_D | DistanceMatrix (‘SpMAD’) |
2D | |
925 | LogEE_D | DistanceMatrix (‘LogEE’) |
2D | |
926 | SM1_D | DistanceMatrix (‘SM1’) |
2D | |
927 | VE1_D | DistanceMatrix (‘VE1’) |
2D | |
928 | VE2_D | DistanceMatrix (‘VE2’) |
2D | |
929 | VE3_D | DistanceMatrix (‘VE3’) |
2D | |
930 | VR1_D | DistanceMatrix (‘VR1’) |
2D | |
931 | VR2_D | DistanceMatrix (‘VR2’) |
2D | |
932 | VR3_D | DistanceMatrix (‘VR3’) |
2D | |
933 | EState |
NsLi | AtomTypeEState (‘count’, ‘sLi’) |
2D |
934 | NssBe | AtomTypeEState (‘count’, ‘ssBe’) |
2D | |
935 | NssssBe | AtomTypeEState (‘count’, ‘ssssBe’) |
2D | |
936 | NssBH | AtomTypeEState (‘count’, ‘ssBH’) |
2D | |
937 | NsssB | AtomTypeEState (‘count’, ‘sssB’) |
2D | |
938 | NssssB | AtomTypeEState (‘count’, ‘ssssB’) |
2D | |
939 | NsCH3 | AtomTypeEState (‘count’, ‘sCH3’) |
2D | |
940 | NdCH2 | AtomTypeEState (‘count’, ‘dCH2’) |
2D | |
941 | NssCH2 | AtomTypeEState (‘count’, ‘ssCH2’) |
2D | |
942 | NtCH | AtomTypeEState (‘count’, ‘tCH’) |
2D | |
943 | NdsCH | AtomTypeEState (‘count’, ‘dsCH’) |
2D | |
944 | NaaCH | AtomTypeEState (‘count’, ‘aaCH’) |
2D | |
945 | NsssCH | AtomTypeEState (‘count’, ‘sssCH’) |
2D | |
946 | NddC | AtomTypeEState (‘count’, ‘ddC’) |
2D | |
947 | NtsC | AtomTypeEState (‘count’, ‘tsC’) |
2D | |
948 | NdssC | AtomTypeEState (‘count’, ‘dssC’) |
2D | |
949 | NaasC | AtomTypeEState (‘count’, ‘aasC’) |
2D | |
950 | NaaaC | AtomTypeEState (‘count’, ‘aaaC’) |
2D | |
951 | NssssC | AtomTypeEState (‘count’, ‘ssssC’) |
2D | |
952 | NsNH3 | AtomTypeEState (‘count’, ‘sNH3’) |
2D | |
953 | NsNH2 | AtomTypeEState (‘count’, ‘sNH2’) |
2D | |
954 | NssNH2 | AtomTypeEState (‘count’, ‘ssNH2’) |
2D | |
955 | NdNH | AtomTypeEState (‘count’, ‘dNH’) |
2D | |
956 | NssNH | AtomTypeEState (‘count’, ‘ssNH’) |
2D | |
957 | NaaNH | AtomTypeEState (‘count’, ‘aaNH’) |
2D | |
958 | NtN | AtomTypeEState (‘count’, ‘tN’) |
2D | |
959 | NsssNH | AtomTypeEState (‘count’, ‘sssNH’) |
2D | |
960 | NdsN | AtomTypeEState (‘count’, ‘dsN’) |
2D | |
961 | NaaN | AtomTypeEState (‘count’, ‘aaN’) |
2D | |
962 | NsssN | AtomTypeEState (‘count’, ‘sssN’) |
2D | |
963 | NddsN | AtomTypeEState (‘count’, ‘ddsN’) |
2D | |
964 | NaasN | AtomTypeEState (‘count’, ‘aasN’) |
2D | |
965 | NssssN | AtomTypeEState (‘count’, ‘ssssN’) |
2D | |
966 | NsOH | AtomTypeEState (‘count’, ‘sOH’) |
2D | |
967 | NdO | AtomTypeEState (‘count’, ‘dO’) |
2D | |
968 | NssO | AtomTypeEState (‘count’, ‘ssO’) |
2D | |
969 | NaaO | AtomTypeEState (‘count’, ‘aaO’) |
2D | |
970 | NsF | AtomTypeEState (‘count’, ‘sF’) |
2D | |
971 | NsSiH3 | AtomTypeEState (‘count’, ‘sSiH3’) |
2D | |
972 | NssSiH2 | AtomTypeEState (‘count’, ‘ssSiH2’) |
2D | |
973 | NsssSiH | AtomTypeEState (‘count’, ‘sssSiH’) |
2D | |
974 | NssssSi | AtomTypeEState (‘count’, ‘ssssSi’) |
2D | |
975 | NsPH2 | AtomTypeEState (‘count’, ‘sPH2’) |
2D | |
976 | NssPH | AtomTypeEState (‘count’, ‘ssPH’) |
2D | |
977 | NsssP | AtomTypeEState (‘count’, ‘sssP’) |
2D | |
978 | NdsssP | AtomTypeEState (‘count’, ‘dsssP’) |
2D | |
979 | NsssssP | AtomTypeEState (‘count’, ‘sssssP’) |
2D | |
980 | NsSH | AtomTypeEState (‘count’, ‘sSH’) |
2D | |
981 | NdS | AtomTypeEState (‘count’, ‘dS’) |
2D | |
982 | NssS | AtomTypeEState (‘count’, ‘ssS’) |
2D | |
983 | NaaS | AtomTypeEState (‘count’, ‘aaS’) |
2D | |
984 | NdssS | AtomTypeEState (‘count’, ‘dssS’) |
2D | |
985 | NddssS | AtomTypeEState (‘count’, ‘ddssS’) |
2D | |
986 | NsCl | AtomTypeEState (‘count’, ‘sCl’) |
2D | |
987 | NsGeH3 | AtomTypeEState (‘count’, ‘sGeH3’) |
2D | |
988 | NssGeH2 | AtomTypeEState (‘count’, ‘ssGeH2’) |
2D | |
989 | NsssGeH | AtomTypeEState (‘count’, ‘sssGeH’) |
2D | |
990 | NssssGe | AtomTypeEState (‘count’, ‘ssssGe’) |
2D | |
991 | NsAsH2 | AtomTypeEState (‘count’, ‘sAsH2’) |
2D | |
992 | NssAsH | AtomTypeEState (‘count’, ‘ssAsH’) |
2D | |
993 | NsssAs | AtomTypeEState (‘count’, ‘sssAs’) |
2D | |
994 | NsssdAs | AtomTypeEState (‘count’, ‘sssdAs’) |
2D | |
995 | NsssssAs | AtomTypeEState (‘count’, ‘sssssAs’) |
2D | |
996 | NsSeH | AtomTypeEState (‘count’, ‘sSeH’) |
2D | |
997 | NdSe | AtomTypeEState (‘count’, ‘dSe’) |
2D | |
998 | NssSe | AtomTypeEState (‘count’, ‘ssSe’) |
2D | |
999 | NaaSe | AtomTypeEState (‘count’, ‘aaSe’) |
2D | |
1000 | NdssSe | AtomTypeEState (‘count’, ‘dssSe’) |
2D | |
1001 | NddssSe | AtomTypeEState (‘count’, ‘ddssSe’) |
2D | |
1002 | NsBr | AtomTypeEState (‘count’, ‘sBr’) |
2D | |
1003 | NsSnH3 | AtomTypeEState (‘count’, ‘sSnH3’) |
2D | |
1004 | NssSnH2 | AtomTypeEState (‘count’, ‘ssSnH2’) |
2D | |
1005 | NsssSnH | AtomTypeEState (‘count’, ‘sssSnH’) |
2D | |
1006 | NssssSn | AtomTypeEState (‘count’, ‘ssssSn’) |
2D | |
1007 | NsI | AtomTypeEState (‘count’, ‘sI’) |
2D | |
1008 | NsPbH3 | AtomTypeEState (‘count’, ‘sPbH3’) |
2D | |
1009 | NssPbH2 | AtomTypeEState (‘count’, ‘ssPbH2’) |
2D | |
1010 | NsssPbH | AtomTypeEState (‘count’, ‘sssPbH’) |
2D | |
1011 | NssssPb | AtomTypeEState (‘count’, ‘ssssPb’) |
2D | |
1012 | SsLi | AtomTypeEState (‘sum’, ‘sLi’) |
2D | |
1013 | SssBe | AtomTypeEState (‘sum’, ‘ssBe’) |
2D | |
1014 | SssssBe | AtomTypeEState (‘sum’, ‘ssssBe’) |
2D | |
1015 | SssBH | AtomTypeEState (‘sum’, ‘ssBH’) |
2D | |
1016 | SsssB | AtomTypeEState (‘sum’, ‘sssB’) |
2D | |
1017 | SssssB | AtomTypeEState (‘sum’, ‘ssssB’) |
2D | |
1018 | SsCH3 | AtomTypeEState (‘sum’, ‘sCH3’) |
2D | |
1019 | SdCH2 | AtomTypeEState (‘sum’, ‘dCH2’) |
2D | |
1020 | SssCH2 | AtomTypeEState (‘sum’, ‘ssCH2’) |
2D | |
1021 | StCH | AtomTypeEState (‘sum’, ‘tCH’) |
2D | |
1022 | SdsCH | AtomTypeEState (‘sum’, ‘dsCH’) |
2D | |
1023 | SaaCH | AtomTypeEState (‘sum’, ‘aaCH’) |
2D | |
1024 | SsssCH | AtomTypeEState (‘sum’, ‘sssCH’) |
2D | |
1025 | SddC | AtomTypeEState (‘sum’, ‘ddC’) |
2D | |
1026 | StsC | AtomTypeEState (‘sum’, ‘tsC’) |
2D | |
1027 | SdssC | AtomTypeEState (‘sum’, ‘dssC’) |
2D | |
1028 | SaasC | AtomTypeEState (‘sum’, ‘aasC’) |
2D | |
1029 | SaaaC | AtomTypeEState (‘sum’, ‘aaaC’) |
2D | |
1030 | SssssC | AtomTypeEState (‘sum’, ‘ssssC’) |
2D | |
1031 | SsNH3 | AtomTypeEState (‘sum’, ‘sNH3’) |
2D | |
1032 | SsNH2 | AtomTypeEState (‘sum’, ‘sNH2’) |
2D | |
1033 | SssNH2 | AtomTypeEState (‘sum’, ‘ssNH2’) |
2D | |
1034 | SdNH | AtomTypeEState (‘sum’, ‘dNH’) |
2D | |
1035 | SssNH | AtomTypeEState (‘sum’, ‘ssNH’) |
2D | |
1036 | SaaNH | AtomTypeEState (‘sum’, ‘aaNH’) |
2D | |
1037 | StN | AtomTypeEState (‘sum’, ‘tN’) |
2D | |
1038 | SsssNH | AtomTypeEState (‘sum’, ‘sssNH’) |
2D | |
1039 | SdsN | AtomTypeEState (‘sum’, ‘dsN’) |
2D | |
1040 | SaaN | AtomTypeEState (‘sum’, ‘aaN’) |
2D | |
1041 | SsssN | AtomTypeEState (‘sum’, ‘sssN’) |
2D | |
1042 | SddsN | AtomTypeEState (‘sum’, ‘ddsN’) |
2D | |
1043 | SaasN | AtomTypeEState (‘sum’, ‘aasN’) |
2D | |
1044 | SssssN | AtomTypeEState (‘sum’, ‘ssssN’) |
2D | |
1045 | SsOH | AtomTypeEState (‘sum’, ‘sOH’) |
2D | |
1046 | SdO | AtomTypeEState (‘sum’, ‘dO’) |
2D | |
1047 | SssO | AtomTypeEState (‘sum’, ‘ssO’) |
2D | |
1048 | SaaO | AtomTypeEState (‘sum’, ‘aaO’) |
2D | |
1049 | SsF | AtomTypeEState (‘sum’, ‘sF’) |
2D | |
1050 | SsSiH3 | AtomTypeEState (‘sum’, ‘sSiH3’) |
2D | |
1051 | SssSiH2 | AtomTypeEState (‘sum’, ‘ssSiH2’) |
2D | |
1052 | SsssSiH | AtomTypeEState (‘sum’, ‘sssSiH’) |
2D | |
1053 | SssssSi | AtomTypeEState (‘sum’, ‘ssssSi’) |
2D | |
1054 | SsPH2 | AtomTypeEState (‘sum’, ‘sPH2’) |
2D | |
1055 | SssPH | AtomTypeEState (‘sum’, ‘ssPH’) |
2D | |
1056 | SsssP | AtomTypeEState (‘sum’, ‘sssP’) |
2D | |
1057 | SdsssP | AtomTypeEState (‘sum’, ‘dsssP’) |
2D | |
1058 | SsssssP | AtomTypeEState (‘sum’, ‘sssssP’) |
2D | |
1059 | SsSH | AtomTypeEState (‘sum’, ‘sSH’) |
2D | |
1060 | SdS | AtomTypeEState (‘sum’, ‘dS’) |
2D | |
1061 | SssS | AtomTypeEState (‘sum’, ‘ssS’) |
2D | |
1062 | SaaS | AtomTypeEState (‘sum’, ‘aaS’) |
2D | |
1063 | SdssS | AtomTypeEState (‘sum’, ‘dssS’) |
2D | |
1064 | SddssS | AtomTypeEState (‘sum’, ‘ddssS’) |
2D | |
1065 | SsCl | AtomTypeEState (‘sum’, ‘sCl’) |
2D | |
1066 | SsGeH3 | AtomTypeEState (‘sum’, ‘sGeH3’) |
2D | |
1067 | SssGeH2 | AtomTypeEState (‘sum’, ‘ssGeH2’) |
2D | |
1068 | SsssGeH | AtomTypeEState (‘sum’, ‘sssGeH’) |
2D | |
1069 | SssssGe | AtomTypeEState (‘sum’, ‘ssssGe’) |
2D | |
1070 | SsAsH2 | AtomTypeEState (‘sum’, ‘sAsH2’) |
2D | |
1071 | SssAsH | AtomTypeEState (‘sum’, ‘ssAsH’) |
2D | |
1072 | SsssAs | AtomTypeEState (‘sum’, ‘sssAs’) |
2D | |
1073 | SsssdAs | AtomTypeEState (‘sum’, ‘sssdAs’) |
2D | |
1074 | SsssssAs | AtomTypeEState (‘sum’, ‘sssssAs’) |
2D | |
1075 | SsSeH | AtomTypeEState (‘sum’, ‘sSeH’) |
2D | |
1076 | SdSe | AtomTypeEState (‘sum’, ‘dSe’) |
2D | |
1077 | SssSe | AtomTypeEState (‘sum’, ‘ssSe’) |
2D | |
1078 | SaaSe | AtomTypeEState (‘sum’, ‘aaSe’) |
2D | |
1079 | SdssSe | AtomTypeEState (‘sum’, ‘dssSe’) |
2D | |
1080 | SddssSe | AtomTypeEState (‘sum’, ‘ddssSe’) |
2D | |
1081 | SsBr | AtomTypeEState (‘sum’, ‘sBr’) |
2D | |
1082 | SsSnH3 | AtomTypeEState (‘sum’, ‘sSnH3’) |
2D | |
1083 | SssSnH2 | AtomTypeEState (‘sum’, ‘ssSnH2’) |
2D | |
1084 | SsssSnH | AtomTypeEState (‘sum’, ‘sssSnH’) |
2D | |
1085 | SssssSn | AtomTypeEState (‘sum’, ‘ssssSn’) |
2D | |
1086 | SsI | AtomTypeEState (‘sum’, ‘sI’) |
2D | |
1087 | SsPbH3 | AtomTypeEState (‘sum’, ‘sPbH3’) |
2D | |
1088 | SssPbH2 | AtomTypeEState (‘sum’, ‘ssPbH2’) |
2D | |
1089 | SsssPbH | AtomTypeEState (‘sum’, ‘sssPbH’) |
2D | |
1090 | SssssPb | AtomTypeEState (‘sum’, ‘ssssPb’) |
2D | |
1091 | MAXsLi | AtomTypeEState (‘max’, ‘sLi’) |
2D | |
1092 | MAXssBe | AtomTypeEState (‘max’, ‘ssBe’) |
2D | |
1093 | MAXssssBe | AtomTypeEState (‘max’, ‘ssssBe’) |
2D | |
1094 | MAXssBH | AtomTypeEState (‘max’, ‘ssBH’) |
2D | |
1095 | MAXsssB | AtomTypeEState (‘max’, ‘sssB’) |
2D | |
1096 | MAXssssB | AtomTypeEState (‘max’, ‘ssssB’) |
2D | |
1097 | MAXsCH3 | AtomTypeEState (‘max’, ‘sCH3’) |
2D | |
1098 | MAXdCH2 | AtomTypeEState (‘max’, ‘dCH2’) |
2D | |
1099 | MAXssCH2 | AtomTypeEState (‘max’, ‘ssCH2’) |
2D | |
1100 | MAXtCH | AtomTypeEState (‘max’, ‘tCH’) |
2D | |
1101 | MAXdsCH | AtomTypeEState (‘max’, ‘dsCH’) |
2D | |
1102 | MAXaaCH | AtomTypeEState (‘max’, ‘aaCH’) |
2D | |
1103 | MAXsssCH | AtomTypeEState (‘max’, ‘sssCH’) |
2D | |
1104 | MAXddC | AtomTypeEState (‘max’, ‘ddC’) |
2D | |
1105 | MAXtsC | AtomTypeEState (‘max’, ‘tsC’) |
2D | |
1106 | MAXdssC | AtomTypeEState (‘max’, ‘dssC’) |
2D | |
1107 | MAXaasC | AtomTypeEState (‘max’, ‘aasC’) |
2D | |
1108 | MAXaaaC | AtomTypeEState (‘max’, ‘aaaC’) |
2D | |
1109 | MAXssssC | AtomTypeEState (‘max’, ‘ssssC’) |
2D | |
1110 | MAXsNH3 | AtomTypeEState (‘max’, ‘sNH3’) |
2D | |
1111 | MAXsNH2 | AtomTypeEState (‘max’, ‘sNH2’) |
2D | |
1112 | MAXssNH2 | AtomTypeEState (‘max’, ‘ssNH2’) |
2D | |
1113 | MAXdNH | AtomTypeEState (‘max’, ‘dNH’) |
2D | |
1114 | MAXssNH | AtomTypeEState (‘max’, ‘ssNH’) |
2D | |
1115 | MAXaaNH | AtomTypeEState (‘max’, ‘aaNH’) |
2D | |
1116 | MAXtN | AtomTypeEState (‘max’, ‘tN’) |
2D | |
1117 | MAXsssNH | AtomTypeEState (‘max’, ‘sssNH’) |
2D | |
1118 | MAXdsN | AtomTypeEState (‘max’, ‘dsN’) |
2D | |
1119 | MAXaaN | AtomTypeEState (‘max’, ‘aaN’) |
2D | |
1120 | MAXsssN | AtomTypeEState (‘max’, ‘sssN’) |
2D | |
1121 | MAXddsN | AtomTypeEState (‘max’, ‘ddsN’) |
2D | |
1122 | MAXaasN | AtomTypeEState (‘max’, ‘aasN’) |
2D | |
1123 | MAXssssN | AtomTypeEState (‘max’, ‘ssssN’) |
2D | |
1124 | MAXsOH | AtomTypeEState (‘max’, ‘sOH’) |
2D | |
1125 | MAXdO | AtomTypeEState (‘max’, ‘dO’) |
2D | |
1126 | MAXssO | AtomTypeEState (‘max’, ‘ssO’) |
2D | |
1127 | MAXaaO | AtomTypeEState (‘max’, ‘aaO’) |
2D | |
1128 | MAXsF | AtomTypeEState (‘max’, ‘sF’) |
2D | |
1129 | MAXsSiH3 | AtomTypeEState (‘max’, ‘sSiH3’) |
2D | |
1130 | MAXssSiH2 | AtomTypeEState (‘max’, ‘ssSiH2’) |
2D | |
1131 | MAXsssSiH | AtomTypeEState (‘max’, ‘sssSiH’) |
2D | |
1132 | MAXssssSi | AtomTypeEState (‘max’, ‘ssssSi’) |
2D | |
1133 | MAXsPH2 | AtomTypeEState (‘max’, ‘sPH2’) |
2D | |
1134 | MAXssPH | AtomTypeEState (‘max’, ‘ssPH’) |
2D | |
1135 | MAXsssP | AtomTypeEState (‘max’, ‘sssP’) |
2D | |
1136 | MAXdsssP | AtomTypeEState (‘max’, ‘dsssP’) |
2D | |
1137 | MAXsssssP | AtomTypeEState (‘max’, ‘sssssP’) |
2D | |
1138 | MAXsSH | AtomTypeEState (‘max’, ‘sSH’) |
2D | |
1139 | MAXdS | AtomTypeEState (‘max’, ‘dS’) |
2D | |
1140 | MAXssS | AtomTypeEState (‘max’, ‘ssS’) |
2D | |
1141 | MAXaaS | AtomTypeEState (‘max’, ‘aaS’) |
2D | |
1142 | MAXdssS | AtomTypeEState (‘max’, ‘dssS’) |
2D | |
1143 | MAXddssS | AtomTypeEState (‘max’, ‘ddssS’) |
2D | |
1144 | MAXsCl | AtomTypeEState (‘max’, ‘sCl’) |
2D | |
1145 | MAXsGeH3 | AtomTypeEState (‘max’, ‘sGeH3’) |
2D | |
1146 | MAXssGeH2 | AtomTypeEState (‘max’, ‘ssGeH2’) |
2D | |
1147 | MAXsssGeH | AtomTypeEState (‘max’, ‘sssGeH’) |
2D | |
1148 | MAXssssGe | AtomTypeEState (‘max’, ‘ssssGe’) |
2D | |
1149 | MAXsAsH2 | AtomTypeEState (‘max’, ‘sAsH2’) |
2D | |
1150 | MAXssAsH | AtomTypeEState (‘max’, ‘ssAsH’) |
2D | |
1151 | MAXsssAs | AtomTypeEState (‘max’, ‘sssAs’) |
2D | |
1152 | MAXsssdAs | AtomTypeEState (‘max’, ‘sssdAs’) |
2D | |
1153 | MAXsssssAs | AtomTypeEState (‘max’, ‘sssssAs’) |
2D | |
1154 | MAXsSeH | AtomTypeEState (‘max’, ‘sSeH’) |
2D | |
1155 | MAXdSe | AtomTypeEState (‘max’, ‘dSe’) |
2D | |
1156 | MAXssSe | AtomTypeEState (‘max’, ‘ssSe’) |
2D | |
1157 | MAXaaSe | AtomTypeEState (‘max’, ‘aaSe’) |
2D | |
1158 | MAXdssSe | AtomTypeEState (‘max’, ‘dssSe’) |
2D | |
1159 | MAXddssSe | AtomTypeEState (‘max’, ‘ddssSe’) |
2D | |
1160 | MAXsBr | AtomTypeEState (‘max’, ‘sBr’) |
2D | |
1161 | MAXsSnH3 | AtomTypeEState (‘max’, ‘sSnH3’) |
2D | |
1162 | MAXssSnH2 | AtomTypeEState (‘max’, ‘ssSnH2’) |
2D | |
1163 | MAXsssSnH | AtomTypeEState (‘max’, ‘sssSnH’) |
2D | |
1164 | MAXssssSn | AtomTypeEState (‘max’, ‘ssssSn’) |
2D | |
1165 | MAXsI | AtomTypeEState (‘max’, ‘sI’) |
2D | |
1166 | MAXsPbH3 | AtomTypeEState (‘max’, ‘sPbH3’) |
2D | |
1167 | MAXssPbH2 | AtomTypeEState (‘max’, ‘ssPbH2’) |
2D | |
1168 | MAXsssPbH | AtomTypeEState (‘max’, ‘sssPbH’) |
2D | |
1169 | MAXssssPb | AtomTypeEState (‘max’, ‘ssssPb’) |
2D | |
1170 | MINsLi | AtomTypeEState (‘min’, ‘sLi’) |
2D | |
1171 | MINssBe | AtomTypeEState (‘min’, ‘ssBe’) |
2D | |
1172 | MINssssBe | AtomTypeEState (‘min’, ‘ssssBe’) |
2D | |
1173 | MINssBH | AtomTypeEState (‘min’, ‘ssBH’) |
2D | |
1174 | MINsssB | AtomTypeEState (‘min’, ‘sssB’) |
2D | |
1175 | MINssssB | AtomTypeEState (‘min’, ‘ssssB’) |
2D | |
1176 | MINsCH3 | AtomTypeEState (‘min’, ‘sCH3’) |
2D | |
1177 | MINdCH2 | AtomTypeEState (‘min’, ‘dCH2’) |
2D | |
1178 | MINssCH2 | AtomTypeEState (‘min’, ‘ssCH2’) |
2D | |
1179 | MINtCH | AtomTypeEState (‘min’, ‘tCH’) |
2D | |
1180 | MINdsCH | AtomTypeEState (‘min’, ‘dsCH’) |
2D | |
1181 | MINaaCH | AtomTypeEState (‘min’, ‘aaCH’) |
2D | |
1182 | MINsssCH | AtomTypeEState (‘min’, ‘sssCH’) |
2D | |
1183 | MINddC | AtomTypeEState (‘min’, ‘ddC’) |
2D | |
1184 | MINtsC | AtomTypeEState (‘min’, ‘tsC’) |
2D | |
1185 | MINdssC | AtomTypeEState (‘min’, ‘dssC’) |
2D | |
1186 | MINaasC | AtomTypeEState (‘min’, ‘aasC’) |
2D | |
1187 | MINaaaC | AtomTypeEState (‘min’, ‘aaaC’) |
2D | |
1188 | MINssssC | AtomTypeEState (‘min’, ‘ssssC’) |
2D | |
1189 | MINsNH3 | AtomTypeEState (‘min’, ‘sNH3’) |
2D | |
1190 | MINsNH2 | AtomTypeEState (‘min’, ‘sNH2’) |
2D | |
1191 | MINssNH2 | AtomTypeEState (‘min’, ‘ssNH2’) |
2D | |
1192 | MINdNH | AtomTypeEState (‘min’, ‘dNH’) |
2D | |
1193 | MINssNH | AtomTypeEState (‘min’, ‘ssNH’) |
2D | |
1194 | MINaaNH | AtomTypeEState (‘min’, ‘aaNH’) |
2D | |
1195 | MINtN | AtomTypeEState (‘min’, ‘tN’) |
2D | |
1196 | MINsssNH | AtomTypeEState (‘min’, ‘sssNH’) |
2D | |
1197 | MINdsN | AtomTypeEState (‘min’, ‘dsN’) |
2D | |
1198 | MINaaN | AtomTypeEState (‘min’, ‘aaN’) |
2D | |
1199 | MINsssN | AtomTypeEState (‘min’, ‘sssN’) |
2D | |
1200 | MINddsN | AtomTypeEState (‘min’, ‘ddsN’) |
2D | |
1201 | MINaasN | AtomTypeEState (‘min’, ‘aasN’) |
2D | |
1202 | MINssssN | AtomTypeEState (‘min’, ‘ssssN’) |
2D | |
1203 | MINsOH | AtomTypeEState (‘min’, ‘sOH’) |
2D | |
1204 | MINdO | AtomTypeEState (‘min’, ‘dO’) |
2D | |
1205 | MINssO | AtomTypeEState (‘min’, ‘ssO’) |
2D | |
1206 | MINaaO | AtomTypeEState (‘min’, ‘aaO’) |
2D | |
1207 | MINsF | AtomTypeEState (‘min’, ‘sF’) |
2D | |
1208 | MINsSiH3 | AtomTypeEState (‘min’, ‘sSiH3’) |
2D | |
1209 | MINssSiH2 | AtomTypeEState (‘min’, ‘ssSiH2’) |
2D | |
1210 | MINsssSiH | AtomTypeEState (‘min’, ‘sssSiH’) |
2D | |
1211 | MINssssSi | AtomTypeEState (‘min’, ‘ssssSi’) |
2D | |
1212 | MINsPH2 | AtomTypeEState (‘min’, ‘sPH2’) |
2D | |
1213 | MINssPH | AtomTypeEState (‘min’, ‘ssPH’) |
2D | |
1214 | MINsssP | AtomTypeEState (‘min’, ‘sssP’) |
2D | |
1215 | MINdsssP | AtomTypeEState (‘min’, ‘dsssP’) |
2D | |
1216 | MINsssssP | AtomTypeEState (‘min’, ‘sssssP’) |
2D | |
1217 | MINsSH | AtomTypeEState (‘min’, ‘sSH’) |
2D | |
1218 | MINdS | AtomTypeEState (‘min’, ‘dS’) |
2D | |
1219 | MINssS | AtomTypeEState (‘min’, ‘ssS’) |
2D | |
1220 | MINaaS | AtomTypeEState (‘min’, ‘aaS’) |
2D | |
1221 | MINdssS | AtomTypeEState (‘min’, ‘dssS’) |
2D | |
1222 | MINddssS | AtomTypeEState (‘min’, ‘ddssS’) |
2D | |
1223 | MINsCl | AtomTypeEState (‘min’, ‘sCl’) |
2D | |
1224 | MINsGeH3 | AtomTypeEState (‘min’, ‘sGeH3’) |
2D | |
1225 | MINssGeH2 | AtomTypeEState (‘min’, ‘ssGeH2’) |
2D | |
1226 | MINsssGeH | AtomTypeEState (‘min’, ‘sssGeH’) |
2D | |
1227 | MINssssGe | AtomTypeEState (‘min’, ‘ssssGe’) |
2D | |
1228 | MINsAsH2 | AtomTypeEState (‘min’, ‘sAsH2’) |
2D | |
1229 | MINssAsH | AtomTypeEState (‘min’, ‘ssAsH’) |
2D | |
1230 | MINsssAs | AtomTypeEState (‘min’, ‘sssAs’) |
2D | |
1231 | MINsssdAs | AtomTypeEState (‘min’, ‘sssdAs’) |
2D | |
1232 | MINsssssAs | AtomTypeEState (‘min’, ‘sssssAs’) |
2D | |
1233 | MINsSeH | AtomTypeEState (‘min’, ‘sSeH’) |
2D | |
1234 | MINdSe | AtomTypeEState (‘min’, ‘dSe’) |
2D | |
1235 | MINssSe | AtomTypeEState (‘min’, ‘ssSe’) |
2D | |
1236 | MINaaSe | AtomTypeEState (‘min’, ‘aaSe’) |
2D | |
1237 | MINdssSe | AtomTypeEState (‘min’, ‘dssSe’) |
2D | |
1238 | MINddssSe | AtomTypeEState (‘min’, ‘ddssSe’) |
2D | |
1239 | MINsBr | AtomTypeEState (‘min’, ‘sBr’) |
2D | |
1240 | MINsSnH3 | AtomTypeEState (‘min’, ‘sSnH3’) |
2D | |
1241 | MINssSnH2 | AtomTypeEState (‘min’, ‘ssSnH2’) |
2D | |
1242 | MINsssSnH | AtomTypeEState (‘min’, ‘sssSnH’) |
2D | |
1243 | MINssssSn | AtomTypeEState (‘min’, ‘ssssSn’) |
2D | |
1244 | MINsI | AtomTypeEState (‘min’, ‘sI’) |
2D | |
1245 | MINsPbH3 | AtomTypeEState (‘min’, ‘sPbH3’) |
2D | |
1246 | MINssPbH2 | AtomTypeEState (‘min’, ‘ssPbH2’) |
2D | |
1247 | MINsssPbH | AtomTypeEState (‘min’, ‘sssPbH’) |
2D | |
1248 | MINssssPb | AtomTypeEState (‘min’, ‘ssssPb’) |
2D | |
1249 | EccentricConnectivityIndex |
ECIndex | EccentricConnectivityIndex () |
2D |
1250 | ExtendedTopochemicalAtom |
ETA_alpha | EtaCoreCount (False, False) |
2D |
1251 | AETA_alpha | EtaCoreCount (True, False) |
2D | |
1252 | ETA_shape_p | EtaShapeIndex (‘p’) |
2D | |
1253 | ETA_shape_y | EtaShapeIndex (‘y’) |
2D | |
1254 | ETA_shape_x | EtaShapeIndex (‘x’) |
2D | |
1255 | ETA_beta | EtaVEMCount (‘’, False) |
2D | |
1256 | AETA_beta | EtaVEMCount (‘’, True) |
2D | |
1257 | ETA_beta_s | EtaVEMCount (‘s’, False) |
2D | |
1258 | AETA_beta_s | EtaVEMCount (‘s’, True) |
2D | |
1259 | ETA_beta_ns | EtaVEMCount (‘ns’, False) |
2D | |
1260 | AETA_beta_ns | EtaVEMCount (‘ns’, True) |
2D | |
1261 | ETA_beta_ns_d | EtaVEMCount (‘ns_d’, False) |
2D | |
1262 | AETA_beta_ns_d | EtaVEMCount (‘ns_d’, True) |
2D | |
1263 | ETA_eta | EtaCompositeIndex (False, False, False) |
2D | |
1264 | AETA_eta | EtaCompositeIndex (False, False, True) |
2D | |
1265 | ETA_eta_L | EtaCompositeIndex (False, True, False) |
2D | |
1266 | AETA_eta_L | EtaCompositeIndex (False, True, True) |
2D | |
1267 | ETA_eta_R | EtaCompositeIndex (True, False, False) |
2D | |
1268 | AETA_eta_R | EtaCompositeIndex (True, False, True) |
2D | |
1269 | ETA_eta_RL | EtaCompositeIndex (True, True, False) |
2D | |
1270 | AETA_eta_RL | EtaCompositeIndex (True, True, True) |
2D | |
1271 | ETA_eta_F | EtaFunctionalityIndex (False, False) |
2D | |
1272 | AETA_eta_F | EtaFunctionalityIndex (False, True) |
2D | |
1273 | ETA_eta_FL | EtaFunctionalityIndex (True, False) |
2D | |
1274 | AETA_eta_FL | EtaFunctionalityIndex (True, True) |
2D | |
1275 | ETA_eta_B | EtaBranchingIndex (False, False) |
2D | |
1276 | AETA_eta_B | EtaBranchingIndex (False, True) |
2D | |
1277 | ETA_eta_BR | EtaBranchingIndex (True, False) |
2D | |
1278 | AETA_eta_BR | EtaBranchingIndex (True, True) |
2D | |
1279 | ETA_dAlpha_A | EtaDeltaAlpha (‘A’) |
2D | |
1280 | ETA_dAlpha_B | EtaDeltaAlpha (‘B’) |
2D | |
1281 | ETA_epsilon_1 | EtaEpsilon (1) |
2D | |
1282 | ETA_epsilon_2 | EtaEpsilon (2) |
2D | |
1283 | ETA_epsilon_3 | EtaEpsilon (3) |
2D | |
1284 | ETA_epsilon_4 | EtaEpsilon (4) |
2D | |
1285 | ETA_epsilon_5 | EtaEpsilon (5) |
2D | |
1286 | ETA_dEpsilon_A | EtaDeltaEpsilon (‘A’) |
2D | |
1287 | ETA_dEpsilon_B | EtaDeltaEpsilon (‘B’) |
2D | |
1288 | ETA_dEpsilon_C | EtaDeltaEpsilon (‘C’) |
2D | |
1289 | ETA_dEpsilon_D | EtaDeltaEpsilon (‘D’) |
2D | |
1290 | ETA_dBeta | EtaDeltaBeta (False) |
2D | |
1291 | AETA_dBeta | EtaDeltaBeta (True) |
2D | |
1292 | ETA_psi_1 | EtaPsi () |
2D | |
1293 | ETA_dPsi_A | EtaDeltaPsi (‘A’) |
2D | |
1294 | ETA_dPsi_B | EtaDeltaPsi (‘B’) |
2D | |
1295 | FragmentComplexity |
fragCpx | FragmentComplexity () |
2D |
1296 | Framework |
fMF | Framework () |
2D |
1297 | GeometricalIndex |
GeomDiameter | Diameter3D () |
3D |
1298 | GeomRadius | Radius3D () |
3D | |
1299 | GeomShapeIndex | GeometricalShapeIndex () |
3D | |
1300 | GeomPetitjeanIndex | PetitjeanIndex3D () |
3D | |
1301 | GravitationalIndex |
GRAV | GravitationalIndex (True, False) |
3D |
1302 | GRAVH | GravitationalIndex (False, False) |
3D | |
1303 | GRAVp | GravitationalIndex (True, True) |
3D | |
1304 | GRAVHp | GravitationalIndex (False, True) |
3D | |
1305 | HydrogenBond |
nHBAcc | HBondAcceptor () |
2D |
1306 | nHBDon | HBondDonor () |
2D | |
1307 | InformationContent |
IC0 | InformationContent (0) |
2D |
1308 | IC1 | InformationContent (1) |
2D | |
1309 | IC2 | InformationContent (2) |
2D | |
1310 | IC3 | InformationContent (3) |
2D | |
1311 | IC4 | InformationContent (4) |
2D | |
1312 | IC5 | InformationContent (5) |
2D | |
1313 | TIC0 | TotalIC (0) |
2D | |
1314 | TIC1 | TotalIC (1) |
2D | |
1315 | TIC2 | TotalIC (2) |
2D | |
1316 | TIC3 | TotalIC (3) |
2D | |
1317 | TIC4 | TotalIC (4) |
2D | |
1318 | TIC5 | TotalIC (5) |
2D | |
1319 | SIC0 | StructuralIC (0) |
2D | |
1320 | SIC1 | StructuralIC (1) |
2D | |
1321 | SIC2 | StructuralIC (2) |
2D | |
1322 | SIC3 | StructuralIC (3) |
2D | |
1323 | SIC4 | StructuralIC (4) |
2D | |
1324 | SIC5 | StructuralIC (5) |
2D | |
1325 | BIC0 | BondingIC (0) |
2D | |
1326 | BIC1 | BondingIC (1) |
2D | |
1327 | BIC2 | BondingIC (2) |
2D | |
1328 | BIC3 | BondingIC (3) |
2D | |
1329 | BIC4 | BondingIC (4) |
2D | |
1330 | BIC5 | BondingIC (5) |
2D | |
1331 | CIC0 | ComplementaryIC (0) |
2D | |
1332 | CIC1 | ComplementaryIC (1) |
2D | |
1333 | CIC2 | ComplementaryIC (2) |
2D | |
1334 | CIC3 | ComplementaryIC (3) |
2D | |
1335 | CIC4 | ComplementaryIC (4) |
2D | |
1336 | CIC5 | ComplementaryIC (5) |
2D | |
1337 | MIC0 | ModifiedIC (0) |
2D | |
1338 | MIC1 | ModifiedIC (1) |
2D | |
1339 | MIC2 | ModifiedIC (2) |
2D | |
1340 | MIC3 | ModifiedIC (3) |
2D | |
1341 | MIC4 | ModifiedIC (4) |
2D | |
1342 | MIC5 | ModifiedIC (5) |
2D | |
1343 | ZMIC0 | ZModifiedIC (0) |
2D | |
1344 | ZMIC1 | ZModifiedIC (1) |
2D | |
1345 | ZMIC2 | ZModifiedIC (2) |
2D | |
1346 | ZMIC3 | ZModifiedIC (3) |
2D | |
1347 | ZMIC4 | ZModifiedIC (4) |
2D | |
1348 | ZMIC5 | ZModifiedIC (5) |
2D | |
1349 | KappaShapeIndex |
Kier1 | KappaShapeIndex1 () |
2D |
1350 | Kier2 | KappaShapeIndex2 () |
2D | |
1351 | Kier3 | KappaShapeIndex3 () |
2D | |
1352 | Lipinski |
Lipinski | Lipinski () |
2D |
1353 | GhoseFilter | GhoseFilter () |
2D | |
1354 | McGowanVolume |
VMcGowan | McGowanVolume () |
2D |
1355 | MoRSE |
Mor01 | MoRSE (None, 1) |
3D |
1356 | Mor02 | MoRSE (None, 2) |
3D | |
1357 | Mor03 | MoRSE (None, 3) |
3D | |
1358 | Mor04 | MoRSE (None, 4) |
3D | |
1359 | Mor05 | MoRSE (None, 5) |
3D | |
1360 | Mor06 | MoRSE (None, 6) |
3D | |
1361 | Mor07 | MoRSE (None, 7) |
3D | |
1362 | Mor08 | MoRSE (None, 8) |
3D | |
1363 | Mor09 | MoRSE (None, 9) |
3D | |
1364 | Mor10 | MoRSE (None, 10) |
3D | |
1365 | Mor11 | MoRSE (None, 11) |
3D | |
1366 | Mor12 | MoRSE (None, 12) |
3D | |
1367 | Mor13 | MoRSE (None, 13) |
3D | |
1368 | Mor14 | MoRSE (None, 14) |
3D | |
1369 | Mor15 | MoRSE (None, 15) |
3D | |
1370 | Mor16 | MoRSE (None, 16) |
3D | |
1371 | Mor17 | MoRSE (None, 17) |
3D | |
1372 | Mor18 | MoRSE (None, 18) |
3D | |
1373 | Mor19 | MoRSE (None, 19) |
3D | |
1374 | Mor20 | MoRSE (None, 20) |
3D | |
1375 | Mor21 | MoRSE (None, 21) |
3D | |
1376 | Mor22 | MoRSE (None, 22) |
3D | |
1377 | Mor23 | MoRSE (None, 23) |
3D | |
1378 | Mor24 | MoRSE (None, 24) |
3D | |
1379 | Mor25 | MoRSE (None, 25) |
3D | |
1380 | Mor26 | MoRSE (None, 26) |
3D | |
1381 | Mor27 | MoRSE (None, 27) |
3D | |
1382 | Mor28 | MoRSE (None, 28) |
3D | |
1383 | Mor29 | MoRSE (None, 29) |
3D | |
1384 | Mor30 | MoRSE (None, 30) |
3D | |
1385 | Mor31 | MoRSE (None, 31) |
3D | |
1386 | Mor32 | MoRSE (None, 32) |
3D | |
1387 | Mor01m | MoRSE (‘m’, 1) |
3D | |
1388 | Mor02m | MoRSE (‘m’, 2) |
3D | |
1389 | Mor03m | MoRSE (‘m’, 3) |
3D | |
1390 | Mor04m | MoRSE (‘m’, 4) |
3D | |
1391 | Mor05m | MoRSE (‘m’, 5) |
3D | |
1392 | Mor06m | MoRSE (‘m’, 6) |
3D | |
1393 | Mor07m | MoRSE (‘m’, 7) |
3D | |
1394 | Mor08m | MoRSE (‘m’, 8) |
3D | |
1395 | Mor09m | MoRSE (‘m’, 9) |
3D | |
1396 | Mor10m | MoRSE (‘m’, 10) |
3D | |
1397 | Mor11m | MoRSE (‘m’, 11) |
3D | |
1398 | Mor12m | MoRSE (‘m’, 12) |
3D | |
1399 | Mor13m | MoRSE (‘m’, 13) |
3D | |
1400 | Mor14m | MoRSE (‘m’, 14) |
3D | |
1401 | Mor15m | MoRSE (‘m’, 15) |
3D | |
1402 | Mor16m | MoRSE (‘m’, 16) |
3D | |
1403 | Mor17m | MoRSE (‘m’, 17) |
3D | |
1404 | Mor18m | MoRSE (‘m’, 18) |
3D | |
1405 | Mor19m | MoRSE (‘m’, 19) |
3D | |
1406 | Mor20m | MoRSE (‘m’, 20) |
3D | |
1407 | Mor21m | MoRSE (‘m’, 21) |
3D | |
1408 | Mor22m | MoRSE (‘m’, 22) |
3D | |
1409 | Mor23m | MoRSE (‘m’, 23) |
3D | |
1410 | Mor24m | MoRSE (‘m’, 24) |
3D | |
1411 | Mor25m | MoRSE (‘m’, 25) |
3D | |
1412 | Mor26m | MoRSE (‘m’, 26) |
3D | |
1413 | Mor27m | MoRSE (‘m’, 27) |
3D | |
1414 | Mor28m | MoRSE (‘m’, 28) |
3D | |
1415 | Mor29m | MoRSE (‘m’, 29) |
3D | |
1416 | Mor30m | MoRSE (‘m’, 30) |
3D | |
1417 | Mor31m | MoRSE (‘m’, 31) |
3D | |
1418 | Mor32m | MoRSE (‘m’, 32) |
3D | |
1419 | Mor01v | MoRSE (‘v’, 1) |
3D | |
1420 | Mor02v | MoRSE (‘v’, 2) |
3D | |
1421 | Mor03v | MoRSE (‘v’, 3) |
3D | |
1422 | Mor04v | MoRSE (‘v’, 4) |
3D | |
1423 | Mor05v | MoRSE (‘v’, 5) |
3D | |
1424 | Mor06v | MoRSE (‘v’, 6) |
3D | |
1425 | Mor07v | MoRSE (‘v’, 7) |
3D | |
1426 | Mor08v | MoRSE (‘v’, 8) |
3D | |
1427 | Mor09v | MoRSE (‘v’, 9) |
3D | |
1428 | Mor10v | MoRSE (‘v’, 10) |
3D | |
1429 | Mor11v | MoRSE (‘v’, 11) |
3D | |
1430 | Mor12v | MoRSE (‘v’, 12) |
3D | |
1431 | Mor13v | MoRSE (‘v’, 13) |
3D | |
1432 | Mor14v | MoRSE (‘v’, 14) |
3D | |
1433 | Mor15v | MoRSE (‘v’, 15) |
3D | |
1434 | Mor16v | MoRSE (‘v’, 16) |
3D | |
1435 | Mor17v | MoRSE (‘v’, 17) |
3D | |
1436 | Mor18v | MoRSE (‘v’, 18) |
3D | |
1437 | Mor19v | MoRSE (‘v’, 19) |
3D | |
1438 | Mor20v | MoRSE (‘v’, 20) |
3D | |
1439 | Mor21v | MoRSE (‘v’, 21) |
3D | |
1440 | Mor22v | MoRSE (‘v’, 22) |
3D | |
1441 | Mor23v | MoRSE (‘v’, 23) |
3D | |
1442 | Mor24v | MoRSE (‘v’, 24) |
3D | |
1443 | Mor25v | MoRSE (‘v’, 25) |
3D | |
1444 | Mor26v | MoRSE (‘v’, 26) |
3D | |
1445 | Mor27v | MoRSE (‘v’, 27) |
3D | |
1446 | Mor28v | MoRSE (‘v’, 28) |
3D | |
1447 | Mor29v | MoRSE (‘v’, 29) |
3D | |
1448 | Mor30v | MoRSE (‘v’, 30) |
3D | |
1449 | Mor31v | MoRSE (‘v’, 31) |
3D | |
1450 | Mor32v | MoRSE (‘v’, 32) |
3D | |
1451 | Mor01se | MoRSE (‘se’, 1) |
3D | |
1452 | Mor02se | MoRSE (‘se’, 2) |
3D | |
1453 | Mor03se | MoRSE (‘se’, 3) |
3D | |
1454 | Mor04se | MoRSE (‘se’, 4) |
3D | |
1455 | Mor05se | MoRSE (‘se’, 5) |
3D | |
1456 | Mor06se | MoRSE (‘se’, 6) |
3D | |
1457 | Mor07se | MoRSE (‘se’, 7) |
3D | |
1458 | Mor08se | MoRSE (‘se’, 8) |
3D | |
1459 | Mor09se | MoRSE (‘se’, 9) |
3D | |
1460 | Mor10se | MoRSE (‘se’, 10) |
3D | |
1461 | Mor11se | MoRSE (‘se’, 11) |
3D | |
1462 | Mor12se | MoRSE (‘se’, 12) |
3D | |
1463 | Mor13se | MoRSE (‘se’, 13) |
3D | |
1464 | Mor14se | MoRSE (‘se’, 14) |
3D | |
1465 | Mor15se | MoRSE (‘se’, 15) |
3D | |
1466 | Mor16se | MoRSE (‘se’, 16) |
3D | |
1467 | Mor17se | MoRSE (‘se’, 17) |
3D | |
1468 | Mor18se | MoRSE (‘se’, 18) |
3D | |
1469 | Mor19se | MoRSE (‘se’, 19) |
3D | |
1470 | Mor20se | MoRSE (‘se’, 20) |
3D | |
1471 | Mor21se | MoRSE (‘se’, 21) |
3D | |
1472 | Mor22se | MoRSE (‘se’, 22) |
3D | |
1473 | Mor23se | MoRSE (‘se’, 23) |
3D | |
1474 | Mor24se | MoRSE (‘se’, 24) |
3D | |
1475 | Mor25se | MoRSE (‘se’, 25) |
3D | |
1476 | Mor26se | MoRSE (‘se’, 26) |
3D | |
1477 | Mor27se | MoRSE (‘se’, 27) |
3D | |
1478 | Mor28se | MoRSE (‘se’, 28) |
3D | |
1479 | Mor29se | MoRSE (‘se’, 29) |
3D | |
1480 | Mor30se | MoRSE (‘se’, 30) |
3D | |
1481 | Mor31se | MoRSE (‘se’, 31) |
3D | |
1482 | Mor32se | MoRSE (‘se’, 32) |
3D | |
1483 | Mor01p | MoRSE (‘p’, 1) |
3D | |
1484 | Mor02p | MoRSE (‘p’, 2) |
3D | |
1485 | Mor03p | MoRSE (‘p’, 3) |
3D | |
1486 | Mor04p | MoRSE (‘p’, 4) |
3D | |
1487 | Mor05p | MoRSE (‘p’, 5) |
3D | |
1488 | Mor06p | MoRSE (‘p’, 6) |
3D | |
1489 | Mor07p | MoRSE (‘p’, 7) |
3D | |
1490 | Mor08p | MoRSE (‘p’, 8) |
3D | |
1491 | Mor09p | MoRSE (‘p’, 9) |
3D | |
1492 | Mor10p | MoRSE (‘p’, 10) |
3D | |
1493 | Mor11p | MoRSE (‘p’, 11) |
3D | |
1494 | Mor12p | MoRSE (‘p’, 12) |
3D | |
1495 | Mor13p | MoRSE (‘p’, 13) |
3D | |
1496 | Mor14p | MoRSE (‘p’, 14) |
3D | |
1497 | Mor15p | MoRSE (‘p’, 15) |
3D | |
1498 | Mor16p | MoRSE (‘p’, 16) |
3D | |
1499 | Mor17p | MoRSE (‘p’, 17) |
3D | |
1500 | Mor18p | MoRSE (‘p’, 18) |
3D | |
1501 | Mor19p | MoRSE (‘p’, 19) |
3D | |
1502 | Mor20p | MoRSE (‘p’, 20) |
3D | |
1503 | Mor21p | MoRSE (‘p’, 21) |
3D | |
1504 | Mor22p | MoRSE (‘p’, 22) |
3D | |
1505 | Mor23p | MoRSE (‘p’, 23) |
3D | |
1506 | Mor24p | MoRSE (‘p’, 24) |
3D | |
1507 | Mor25p | MoRSE (‘p’, 25) |
3D | |
1508 | Mor26p | MoRSE (‘p’, 26) |
3D | |
1509 | Mor27p | MoRSE (‘p’, 27) |
3D | |
1510 | Mor28p | MoRSE (‘p’, 28) |
3D | |
1511 | Mor29p | MoRSE (‘p’, 29) |
3D | |
1512 | Mor30p | MoRSE (‘p’, 30) |
3D | |
1513 | Mor31p | MoRSE (‘p’, 31) |
3D | |
1514 | Mor32p | MoRSE (‘p’, 32) |
3D | |
1515 | MoeType |
LabuteASA | LabuteASA () |
2D |
1516 | PEOE_VSA1 | PEOE_VSA (1) |
2D | |
1517 | PEOE_VSA2 | PEOE_VSA (2) |
2D | |
1518 | PEOE_VSA3 | PEOE_VSA (3) |
2D | |
1519 | PEOE_VSA4 | PEOE_VSA (4) |
2D | |
1520 | PEOE_VSA5 | PEOE_VSA (5) |
2D | |
1521 | PEOE_VSA6 | PEOE_VSA (6) |
2D | |
1522 | PEOE_VSA7 | PEOE_VSA (7) |
2D | |
1523 | PEOE_VSA8 | PEOE_VSA (8) |
2D | |
1524 | PEOE_VSA9 | PEOE_VSA (9) |
2D | |
1525 | PEOE_VSA10 | PEOE_VSA (10) |
2D | |
1526 | PEOE_VSA11 | PEOE_VSA (11) |
2D | |
1527 | PEOE_VSA12 | PEOE_VSA (12) |
2D | |
1528 | PEOE_VSA13 | PEOE_VSA (13) |
2D | |
1529 | SMR_VSA1 | SMR_VSA (1) |
2D | |
1530 | SMR_VSA2 | SMR_VSA (2) |
2D | |
1531 | SMR_VSA3 | SMR_VSA (3) |
2D | |
1532 | SMR_VSA4 | SMR_VSA (4) |
2D | |
1533 | SMR_VSA5 | SMR_VSA (5) |
2D | |
1534 | SMR_VSA6 | SMR_VSA (6) |
2D | |
1535 | SMR_VSA7 | SMR_VSA (7) |
2D | |
1536 | SMR_VSA8 | SMR_VSA (8) |
2D | |
1537 | SMR_VSA9 | SMR_VSA (9) |
2D | |
1538 | SlogP_VSA1 | SlogP_VSA (1) |
2D | |
1539 | SlogP_VSA2 | SlogP_VSA (2) |
2D | |
1540 | SlogP_VSA3 | SlogP_VSA (3) |
2D | |
1541 | SlogP_VSA4 | SlogP_VSA (4) |
2D | |
1542 | SlogP_VSA5 | SlogP_VSA (5) |
2D | |
1543 | SlogP_VSA6 | SlogP_VSA (6) |
2D | |
1544 | SlogP_VSA7 | SlogP_VSA (7) |
2D | |
1545 | SlogP_VSA8 | SlogP_VSA (8) |
2D | |
1546 | SlogP_VSA9 | SlogP_VSA (9) |
2D | |
1547 | SlogP_VSA10 | SlogP_VSA (10) |
2D | |
1548 | SlogP_VSA11 | SlogP_VSA (11) |
2D | |
1549 | EState_VSA1 | EState_VSA (1) |
2D | |
1550 | EState_VSA2 | EState_VSA (2) |
2D | |
1551 | EState_VSA3 | EState_VSA (3) |
2D | |
1552 | EState_VSA4 | EState_VSA (4) |
2D | |
1553 | EState_VSA5 | EState_VSA (5) |
2D | |
1554 | EState_VSA6 | EState_VSA (6) |
2D | |
1555 | EState_VSA7 | EState_VSA (7) |
2D | |
1556 | EState_VSA8 | EState_VSA (8) |
2D | |
1557 | EState_VSA9 | EState_VSA (9) |
2D | |
1558 | EState_VSA10 | EState_VSA (10) |
2D | |
1559 | VSA_EState1 | VSA_EState (1) |
2D | |
1560 | VSA_EState2 | VSA_EState (2) |
2D | |
1561 | VSA_EState3 | VSA_EState (3) |
2D | |
1562 | VSA_EState4 | VSA_EState (4) |
2D | |
1563 | VSA_EState5 | VSA_EState (5) |
2D | |
1564 | VSA_EState6 | VSA_EState (6) |
2D | |
1565 | VSA_EState7 | VSA_EState (7) |
2D | |
1566 | VSA_EState8 | VSA_EState (8) |
2D | |
1567 | VSA_EState9 | VSA_EState (9) |
2D | |
1568 | MolecularDistanceEdge |
MDEC-11 | MolecularDistanceEdge (1, 1, 6) |
2D |
1569 | MDEC-12 | MolecularDistanceEdge (1, 2, 6) |
2D | |
1570 | MDEC-13 | MolecularDistanceEdge (1, 3, 6) |
2D | |
1571 | MDEC-14 | MolecularDistanceEdge (1, 4, 6) |
2D | |
1572 | MDEC-22 | MolecularDistanceEdge (2, 2, 6) |
2D | |
1573 | MDEC-23 | MolecularDistanceEdge (2, 3, 6) |
2D | |
1574 | MDEC-24 | MolecularDistanceEdge (2, 4, 6) |
2D | |
1575 | MDEC-33 | MolecularDistanceEdge (3, 3, 6) |
2D | |
1576 | MDEC-34 | MolecularDistanceEdge (3, 4, 6) |
2D | |
1577 | MDEC-44 | MolecularDistanceEdge (4, 4, 6) |
2D | |
1578 | MDEO-11 | MolecularDistanceEdge (1, 1, 8) |
2D | |
1579 | MDEO-12 | MolecularDistanceEdge (1, 2, 8) |
2D | |
1580 | MDEO-22 | MolecularDistanceEdge (2, 2, 8) |
2D | |
1581 | MDEN-11 | MolecularDistanceEdge (1, 1, 7) |
2D | |
1582 | MDEN-12 | MolecularDistanceEdge (1, 2, 7) |
2D | |
1583 | MDEN-13 | MolecularDistanceEdge (1, 3, 7) |
2D | |
1584 | MDEN-22 | MolecularDistanceEdge (2, 2, 7) |
2D | |
1585 | MDEN-23 | MolecularDistanceEdge (2, 3, 7) |
2D | |
1586 | MDEN-33 | MolecularDistanceEdge (3, 3, 7) |
2D | |
1587 | MolecularId |
MID | MolecularId (‘any’, False, 1e-10) |
2D |
1588 | AMID | MolecularId (‘any’, True, 1e-10) |
2D | |
1589 | MID_h | MolecularId (‘hetero’, False, 1e-10) |
2D | |
1590 | AMID_h | MolecularId (‘hetero’, True, 1e-10) |
2D | |
1591 | MID_C | MolecularId (‘C’, False, 1e-10) |
2D | |
1592 | AMID_C | MolecularId (‘C’, True, 1e-10) |
2D | |
1593 | MID_N | MolecularId (‘N’, False, 1e-10) |
2D | |
1594 | AMID_N | MolecularId (‘N’, True, 1e-10) |
2D | |
1595 | MID_O | MolecularId (‘O’, False, 1e-10) |
2D | |
1596 | AMID_O | MolecularId (‘O’, True, 1e-10) |
2D | |
1597 | MID_X | MolecularId (‘X’, False, 1e-10) |
2D | |
1598 | AMID_X | MolecularId (‘X’, True, 1e-10) |
2D | |
1599 | MomentOfInertia |
MOMI-X | MomentOfInertia (‘X’) |
3D |
1600 | MOMI-Y | MomentOfInertia (‘Y’) |
3D | |
1601 | MOMI-Z | MomentOfInertia (‘Z’) |
3D | |
1602 | PathCount |
MPC2 | PathCount (2, False, False, False) |
2D |
1603 | MPC3 | PathCount (3, False, False, False) |
2D | |
1604 | MPC4 | PathCount (4, False, False, False) |
2D | |
1605 | MPC5 | PathCount (5, False, False, False) |
2D | |
1606 | MPC6 | PathCount (6, False, False, False) |
2D | |
1607 | MPC7 | PathCount (7, False, False, False) |
2D | |
1608 | MPC8 | PathCount (8, False, False, False) |
2D | |
1609 | MPC9 | PathCount (9, False, False, False) |
2D | |
1610 | MPC10 | PathCount (10, False, False, False) |
2D | |
1611 | TMPC10 | PathCount (10, False, True, False) |
2D | |
1612 | piPC1 | PathCount (1, True, False, True) |
2D | |
1613 | piPC2 | PathCount (2, True, False, True) |
2D | |
1614 | piPC3 | PathCount (3, True, False, True) |
2D | |
1615 | piPC4 | PathCount (4, True, False, True) |
2D | |
1616 | piPC5 | PathCount (5, True, False, True) |
2D | |
1617 | piPC6 | PathCount (6, True, False, True) |
2D | |
1618 | piPC7 | PathCount (7, True, False, True) |
2D | |
1619 | piPC8 | PathCount (8, True, False, True) |
2D | |
1620 | piPC9 | PathCount (9, True, False, True) |
2D | |
1621 | piPC10 | PathCount (10, True, False, True) |
2D | |
1622 | TpiPC10 | PathCount (10, True, True, True) |
2D | |
1623 | Polarizability |
apol | APol (False) |
2D |
1624 | bpol | BPol (False) |
2D | |
1625 | RingCount |
nRing | RingCount (None, False, False, None, None) |
2D |
1626 | n3Ring | RingCount (3, False, False, None, None) |
2D | |
1627 | n4Ring | RingCount (4, False, False, None, None) |
2D | |
1628 | n5Ring | RingCount (5, False, False, None, None) |
2D | |
1629 | n6Ring | RingCount (6, False, False, None, None) |
2D | |
1630 | n7Ring | RingCount (7, False, False, None, None) |
2D | |
1631 | n8Ring | RingCount (8, False, False, None, None) |
2D | |
1632 | n9Ring | RingCount (9, False, False, None, None) |
2D | |
1633 | n10Ring | RingCount (10, False, False, None, None) |
2D | |
1634 | n11Ring | RingCount (11, False, False, None, None) |
2D | |
1635 | n12Ring | RingCount (12, False, False, None, None) |
2D | |
1636 | nG12Ring | RingCount (12, True, False, None, None) |
2D | |
1637 | nHRing | RingCount (None, False, False, None, True) |
2D | |
1638 | n3HRing | RingCount (3, False, False, None, True) |
2D | |
1639 | n4HRing | RingCount (4, False, False, None, True) |
2D | |
1640 | n5HRing | RingCount (5, False, False, None, True) |
2D | |
1641 | n6HRing | RingCount (6, False, False, None, True) |
2D | |
1642 | n7HRing | RingCount (7, False, False, None, True) |
2D | |
1643 | n8HRing | RingCount (8, False, False, None, True) |
2D | |
1644 | n9HRing | RingCount (9, False, False, None, True) |
2D | |
1645 | n10HRing | RingCount (10, False, False, None, True) |
2D | |
1646 | n11HRing | RingCount (11, False, False, None, True) |
2D | |
1647 | n12HRing | RingCount (12, False, False, None, True) |
2D | |
1648 | nG12HRing | RingCount (12, True, False, None, True) |
2D | |
1649 | naRing | RingCount (None, False, False, True, None) |
2D | |
1650 | n3aRing | RingCount (3, False, False, True, None) |
2D | |
1651 | n4aRing | RingCount (4, False, False, True, None) |
2D | |
1652 | n5aRing | RingCount (5, False, False, True, None) |
2D | |
1653 | n6aRing | RingCount (6, False, False, True, None) |
2D | |
1654 | n7aRing | RingCount (7, False, False, True, None) |
2D | |
1655 | n8aRing | RingCount (8, False, False, True, None) |
2D | |
1656 | n9aRing | RingCount (9, False, False, True, None) |
2D | |
1657 | n10aRing | RingCount (10, False, False, True, None) |
2D | |
1658 | n11aRing | RingCount (11, False, False, True, None) |
2D | |
1659 | n12aRing | RingCount (12, False, False, True, None) |
2D | |
1660 | nG12aRing | RingCount (12, True, False, True, None) |
2D | |
1661 | naHRing | RingCount (None, False, False, True, True) |
2D | |
1662 | n3aHRing | RingCount (3, False, False, True, True) |
2D | |
1663 | n4aHRing | RingCount (4, False, False, True, True) |
2D | |
1664 | n5aHRing | RingCount (5, False, False, True, True) |
2D | |
1665 | n6aHRing | RingCount (6, False, False, True, True) |
2D | |
1666 | n7aHRing | RingCount (7, False, False, True, True) |
2D | |
1667 | n8aHRing | RingCount (8, False, False, True, True) |
2D | |
1668 | n9aHRing | RingCount (9, False, False, True, True) |
2D | |
1669 | n10aHRing | RingCount (10, False, False, True, True) |
2D | |
1670 | n11aHRing | RingCount (11, False, False, True, True) |
2D | |
1671 | n12aHRing | RingCount (12, False, False, True, True) |
2D | |
1672 | nG12aHRing | RingCount (12, True, False, True, True) |
2D | |
1673 | nARing | RingCount (None, False, False, False, None) |
2D | |
1674 | n3ARing | RingCount (3, False, False, False, None) |
2D | |
1675 | n4ARing | RingCount (4, False, False, False, None) |
2D | |
1676 | n5ARing | RingCount (5, False, False, False, None) |
2D | |
1677 | n6ARing | RingCount (6, False, False, False, None) |
2D | |
1678 | n7ARing | RingCount (7, False, False, False, None) |
2D | |
1679 | n8ARing | RingCount (8, False, False, False, None) |
2D | |
1680 | n9ARing | RingCount (9, False, False, False, None) |
2D | |
1681 | n10ARing | RingCount (10, False, False, False, None) |
2D | |
1682 | n11ARing | RingCount (11, False, False, False, None) |
2D | |
1683 | n12ARing | RingCount (12, False, False, False, None) |
2D | |
1684 | nG12ARing | RingCount (12, True, False, False, None) |
2D | |
1685 | nAHRing | RingCount (None, False, False, False, True) |
2D | |
1686 | n3AHRing | RingCount (3, False, False, False, True) |
2D | |
1687 | n4AHRing | RingCount (4, False, False, False, True) |
2D | |
1688 | n5AHRing | RingCount (5, False, False, False, True) |
2D | |
1689 | n6AHRing | RingCount (6, False, False, False, True) |
2D | |
1690 | n7AHRing | RingCount (7, False, False, False, True) |
2D | |
1691 | n8AHRing | RingCount (8, False, False, False, True) |
2D | |
1692 | n9AHRing | RingCount (9, False, False, False, True) |
2D | |
1693 | n10AHRing | RingCount (10, False, False, False, True) |
2D | |
1694 | n11AHRing | RingCount (11, False, False, False, True) |
2D | |
1695 | n12AHRing | RingCount (12, False, False, False, True) |
2D | |
1696 | nG12AHRing | RingCount (12, True, False, False, True) |
2D | |
1697 | nFRing | RingCount (None, False, True, None, None) |
2D | |
1698 | n4FRing | RingCount (4, False, True, None, None) |
2D | |
1699 | n5FRing | RingCount (5, False, True, None, None) |
2D | |
1700 | n6FRing | RingCount (6, False, True, None, None) |
2D | |
1701 | n7FRing | RingCount (7, False, True, None, None) |
2D | |
1702 | n8FRing | RingCount (8, False, True, None, None) |
2D | |
1703 | n9FRing | RingCount (9, False, True, None, None) |
2D | |
1704 | n10FRing | RingCount (10, False, True, None, None) |
2D | |
1705 | n11FRing | RingCount (11, False, True, None, None) |
2D | |
1706 | n12FRing | RingCount (12, False, True, None, None) |
2D | |
1707 | nG12FRing | RingCount (12, True, True, None, None) |
2D | |
1708 | nFHRing | RingCount (None, False, True, None, True) |
2D | |
1709 | n4FHRing | RingCount (4, False, True, None, True) |
2D | |
1710 | n5FHRing | RingCount (5, False, True, None, True) |
2D | |
1711 | n6FHRing | RingCount (6, False, True, None, True) |
2D | |
1712 | n7FHRing | RingCount (7, False, True, None, True) |
2D | |
1713 | n8FHRing | RingCount (8, False, True, None, True) |
2D | |
1714 | n9FHRing | RingCount (9, False, True, None, True) |
2D | |
1715 | n10FHRing | RingCount (10, False, True, None, True) |
2D | |
1716 | n11FHRing | RingCount (11, False, True, None, True) |
2D | |
1717 | n12FHRing | RingCount (12, False, True, None, True) |
2D | |
1718 | nG12FHRing | RingCount (12, True, True, None, True) |
2D | |
1719 | nFaRing | RingCount (None, False, True, True, None) |
2D | |
1720 | n4FaRing | RingCount (4, False, True, True, None) |
2D | |
1721 | n5FaRing | RingCount (5, False, True, True, None) |
2D | |
1722 | n6FaRing | RingCount (6, False, True, True, None) |
2D | |
1723 | n7FaRing | RingCount (7, False, True, True, None) |
2D | |
1724 | n8FaRing | RingCount (8, False, True, True, None) |
2D | |
1725 | n9FaRing | RingCount (9, False, True, True, None) |
2D | |
1726 | n10FaRing | RingCount (10, False, True, True, None) |
2D | |
1727 | n11FaRing | RingCount (11, False, True, True, None) |
2D | |
1728 | n12FaRing | RingCount (12, False, True, True, None) |
2D | |
1729 | nG12FaRing | RingCount (12, True, True, True, None) |
2D | |
1730 | nFaHRing | RingCount (None, False, True, True, True) |
2D | |
1731 | n4FaHRing | RingCount (4, False, True, True, True) |
2D | |
1732 | n5FaHRing | RingCount (5, False, True, True, True) |
2D | |
1733 | n6FaHRing | RingCount (6, False, True, True, True) |
2D | |
1734 | n7FaHRing | RingCount (7, False, True, True, True) |
2D | |
1735 | n8FaHRing | RingCount (8, False, True, True, True) |
2D | |
1736 | n9FaHRing | RingCount (9, False, True, True, True) |
2D | |
1737 | n10FaHRing | RingCount (10, False, True, True, True) |
2D | |
1738 | n11FaHRing | RingCount (11, False, True, True, True) |
2D | |
1739 | n12FaHRing | RingCount (12, False, True, True, True) |
2D | |
1740 | nG12FaHRing | RingCount (12, True, True, True, True) |
2D | |
1741 | nFARing | RingCount (None, False, True, False, None) |
2D | |
1742 | n4FARing | RingCount (4, False, True, False, None) |
2D | |
1743 | n5FARing | RingCount (5, False, True, False, None) |
2D | |
1744 | n6FARing | RingCount (6, False, True, False, None) |
2D | |
1745 | n7FARing | RingCount (7, False, True, False, None) |
2D | |
1746 | n8FARing | RingCount (8, False, True, False, None) |
2D | |
1747 | n9FARing | RingCount (9, False, True, False, None) |
2D | |
1748 | n10FARing | RingCount (10, False, True, False, None) |
2D | |
1749 | n11FARing | RingCount (11, False, True, False, None) |
2D | |
1750 | n12FARing | RingCount (12, False, True, False, None) |
2D | |
1751 | nG12FARing | RingCount (12, True, True, False, None) |
2D | |
1752 | nFAHRing | RingCount (None, False, True, False, True) |
2D | |
1753 | n4FAHRing | RingCount (4, False, True, False, True) |
2D | |
1754 | n5FAHRing | RingCount (5, False, True, False, True) |
2D | |
1755 | n6FAHRing | RingCount (6, False, True, False, True) |
2D | |
1756 | n7FAHRing | RingCount (7, False, True, False, True) |
2D | |
1757 | n8FAHRing | RingCount (8, False, True, False, True) |
2D | |
1758 | n9FAHRing | RingCount (9, False, True, False, True) |
2D | |
1759 | n10FAHRing | RingCount (10, False, True, False, True) |
2D | |
1760 | n11FAHRing | RingCount (11, False, True, False, True) |
2D | |
1761 | n12FAHRing | RingCount (12, False, True, False, True) |
2D | |
1762 | nG12FAHRing | RingCount (12, True, True, False, True) |
2D | |
1763 | RotatableBond |
nRot | RotatableBondsCount () |
2D |
1764 | RotRatio | RotatableBondsRatio () |
2D | |
1765 | SLogP |
SLogP | SLogP () |
2D |
1766 | SMR | SMR () |
2D | |
1767 | TopoPSA |
TopoPSA(NO) | TopoPSA (True) |
2D |
1768 | TopoPSA | TopoPSA (False) |
2D | |
1769 | TopologicalCharge |
GGI1 | TopologicalCharge (‘raw’, 1) |
2D |
1770 | GGI2 | TopologicalCharge (‘raw’, 2) |
2D | |
1771 | GGI3 | TopologicalCharge (‘raw’, 3) |
2D | |
1772 | GGI4 | TopologicalCharge (‘raw’, 4) |
2D | |
1773 | GGI5 | TopologicalCharge (‘raw’, 5) |
2D | |
1774 | GGI6 | TopologicalCharge (‘raw’, 6) |
2D | |
1775 | GGI7 | TopologicalCharge (‘raw’, 7) |
2D | |
1776 | GGI8 | TopologicalCharge (‘raw’, 8) |
2D | |
1777 | GGI9 | TopologicalCharge (‘raw’, 9) |
2D | |
1778 | GGI10 | TopologicalCharge (‘raw’, 10) |
2D | |
1779 | JGI1 | TopologicalCharge (‘mean’, 1) |
2D | |
1780 | JGI2 | TopologicalCharge (‘mean’, 2) |
2D | |
1781 | JGI3 | TopologicalCharge (‘mean’, 3) |
2D | |
1782 | JGI4 | TopologicalCharge (‘mean’, 4) |
2D | |
1783 | JGI5 | TopologicalCharge (‘mean’, 5) |
2D | |
1784 | JGI6 | TopologicalCharge (‘mean’, 6) |
2D | |
1785 | JGI7 | TopologicalCharge (‘mean’, 7) |
2D | |
1786 | JGI8 | TopologicalCharge (‘mean’, 8) |
2D | |
1787 | JGI9 | TopologicalCharge (‘mean’, 9) |
2D | |
1788 | JGI10 | TopologicalCharge (‘mean’, 10) |
2D | |
1789 | JGT10 | TopologicalCharge (‘global’, 10) |
2D | |
1790 | TopologicalIndex |
Diameter | Diameter () |
2D |
1791 | Radius | Radius () |
2D | |
1792 | TopoShapeIndex | TopologicalShapeIndex () |
2D | |
1793 | PetitjeanIndex | PetitjeanIndex () |
2D | |
1794 | VdwVolumeABC |
Vabc | VdwVolumeABC () |
2D |
1795 | VertexAdjacencyInformation |
VAdjMat | VertexAdjacencyInformation () |
2D |
1796 | WalkCount |
MWC01 | WalkCount (1, False, False) |
2D |
1797 | MWC02 | WalkCount (2, False, False) |
2D | |
1798 | MWC03 | WalkCount (3, False, False) |
2D | |
1799 | MWC04 | WalkCount (4, False, False) |
2D | |
1800 | MWC05 | WalkCount (5, False, False) |
2D | |
1801 | MWC06 | WalkCount (6, False, False) |
2D | |
1802 | MWC07 | WalkCount (7, False, False) |
2D | |
1803 | MWC08 | WalkCount (8, False, False) |
2D | |
1804 | MWC09 | WalkCount (9, False, False) |
2D | |
1805 | MWC10 | WalkCount (10, False, False) |
2D | |
1806 | TMWC10 | WalkCount (10, True, False) |
2D | |
1807 | SRW02 | WalkCount (2, False, True) |
2D | |
1808 | SRW03 | WalkCount (3, False, True) |
2D | |
1809 | SRW04 | WalkCount (4, False, True) |
2D | |
1810 | SRW05 | WalkCount (5, False, True) |
2D | |
1811 | SRW06 | WalkCount (6, False, True) |
2D | |
1812 | SRW07 | WalkCount (7, False, True) |
2D | |
1813 | SRW08 | WalkCount (8, False, True) |
2D | |
1814 | SRW09 | WalkCount (9, False, True) |
2D | |
1815 | SRW10 | WalkCount (10, False, True) |
2D | |
1816 | TSRW10 | WalkCount (10, True, True) |
2D | |
1817 | Weight |
MW | Weight (False) |
2D |
1818 | AMW | Weight (True) |
2D | |
1819 | WienerIndex |
WPath | WienerIndex (False) |
2D |
1820 | WPol | WienerIndex (True) |
2D | |
1821 | ZagrebIndex |
Zagreb1 | ZagrebIndex (1, 1) |
2D |
1822 | Zagreb2 | ZagrebIndex (2, 1) |
2D | |
1823 | mZagreb1 | ZagrebIndex (1, -1) |
2D | |
1824 | mZagreb2 | ZagrebIndex (2, -1) |
2D |