Open AccessObtaining QSPR models for the prediction of physicochemical properties of topical antimicrobials
Author(s) -
Quan Hung Tran,
Juan Polo,
Luis Alberto Zarrabeitía Gómez
Publication year - 2021
Publication title -
proceedings of mol2net'21, conference on molecular, biomedical and computational sciences and engineering, 7th ed.
Language(s) - English
Resource type - Conference proceedings
DOI - 10.3390/mol2net-07-10847
Subject(s) - quantitative structure–activity relationship , partition coefficient , applicability domain , computer science , logarithm , solubility , molecular descriptor , function (biology) , biochemical engineering , biological system , mathematics , chemistry , machine learning , organic chemistry , engineering , mathematical analysis , biology , evolutionary biology