Picture-word order compound protein interaction Predicting compound-protein interaction using structural images of compounds

von Qian, Ying
Veröffentlicht in: Journal of computational chemistry (2022)

Accurate prediction of relative binding affinities of a series of HIV-1 protease inhibitors using semi-empirical quantum mechanical charge

von Peng, Cheng
Veröffentlicht in: Journal of computational chemistry (2020)