Sheng Tian

Comprehensive evaluation of ten docking programs on a diverse set of protein–ligand complexes: the prediction accuracy of sampling power and scoring power

Zhe Wang, Huiyong Sun, Xiaojun Yao et al. · Physical Chemistry Chemical Physics · 2016 · 929 citations

Assessing the performance of MM/PBSA and MM/GBSA methods. 4. Accuracies of MM/PBSA and MM/GBSA methodologies evaluated by various simulation protocols using PDBbind data set

Huiyong Sun, Youyong Li, Sheng Tian et al. · Physical Chemistry Chemical Physics · 2014 · 706 citations

Assessing the performance of MM/PBSA and MM/GBSA methods. 5. Improved docking performance using high solute dielectric constant MM/GBSA and MM/PBSA rescoring

Huiyong Sun, Youyong Li, Mingyun Shen et al. · Physical Chemistry Chemical Physics · 2014 · 519 citations

ADME Evaluation in Drug Discovery. 9. Prediction of Oral Bioavailability in Humans Based on Molecular Properties and Structural Fingerprints

Sheng Tian, Youyong Li, Junmei Wang et al. · Molecular Pharmaceutics · 2011 · 144 citations

ADMET Evaluation in Drug Discovery. 13. Development of<i>in Silico</i>Prediction Models for P-Glycoprotein Substrates

Dan Li, Lei Chen, Youyong Li et al. · Molecular Pharmaceutics · 2014 · 134 citations