Searched refs:R0ct (Results 1 – 1 of 1) sorted by relevance
| /dports/science/rdkit/rdkit-Release_2021_03_5/Code/GraphMol/Descriptors/ |
| H A D | GETAWAY.cpp | 443 double HATSc, HATSct, H0ct, R0ct, H0c, R0c, Rkmaxc, tmpc; in getGETAWAYDescCustom() local
459 R0ct = 0.0; in getGETAWAYDescCustom()
551 R0ct += 2 * getH((double)Wc(j), (double)Wc(k), in getGETAWAYDescCustom()
597 res[35] = roundn(RTc + R0ct, 3); in getGETAWAYDescCustom()
|