-
Hervé MENAGER authored
WIP on #174 this runs on a set of selected compounds: - compute compound properties - cache compound properties - compute drugbank similarity - validate the compound(s) - compute LE-LLE and PCA plots
bf0e7109
WIP on #174 this runs on a set of selected compounds: - compute compound properties - cache compound properties - compute drugbank similarity - validate the compound(s) - compute LE-LLE and PCA plots