Searched refs:HATSct (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
457 HATSct = 0.0; in getGETAWAYDescCustom()
505 HATSct += 2 * getHATS((double)Wc(j), (double)Wc(k), (double)H(j, j), in getGETAWAYDescCustom()
562 double HATSTc = HATSk[0] + HATSct; in getGETAWAYDescCustom()
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