In silico prediction and screening of gamma-secretase inhibitors by molecular descriptors and machine learning methods

par Yang, Xue-Gang
Publié dans: Journal of computational chemistry (2010)

Simulation of DNA electrophoresis in systems of large number of solvent particles by coarse-grained hybrid molecular dynamics approach

par Wang, Rong
Publié dans: Journal of computational chemistry (2009)

Prediction of antibacterial compounds by machine learning approaches

par Yang, Xue-Gang
Publié dans: Journal of computational chemistry (2009)