Yuanrong Fan

发表

Protein–ligand interaction-guided discovery of novel VEGFR-2 inhibitors

Haichun Liu, Yanmin Zhang, T. Lu, 2020, Journal of biomolecular structure & dynamics.

A combined drug discovery strategy based on machine learning and molecular docking

Shuai Lu, Lu Zhu, Tao Lu, 2019, Chemical biology & drug design.

Discovery of potent apoptosis signal-regulating kinase 1 inhibitors via integrated computational strategy and biological evaluation

Haichun Liu, Yanmin Zhang, T. Lu, 2020, Journal of biomolecular structure & dynamics.

In Silico Design and Analysis of a Kinase-Focused Combinatorial Library Considering Diversity and Quality

Li Liang, Yi Hua, Yuchen Wang, 2019, J. Chem. Inf. Model..

Discovery of Dual FGFR4 and EGFR Inhibitors by Machine Learning and Biological Evaluation

Li Liang, Yi Hua, Yuchen Wang, 2020, J. Chem. Inf. Model..

In Silico Prediction of Human Intravenous Pharmacokinetic Parameters with Improved Accuracy

Yan Yang, Yuchen Wang, Yadong Chen, 2019, J. Chem. Inf. Model..

Prediction of hERG K+ channel blockage using deep neural networks

Tao Lu, Yadong Chen, Yuchen Wang, 2019, Chemical biology & drug design.

ADME properties evaluation in drug discovery: in silico prediction of blood–brain partitioning

Haichun Liu, Yanmin Zhang, Yadong Chen, 2018, Molecular Diversity.

Investigation of Crystal Structures in Structure-Based Virtual Screening for Protein Kinase Inhibitors

Lu Zhu, Yi Hua, Yan Yang, 2019, J. Chem. Inf. Model..

Investigation of Machine Intelligence in Compound Cell Activity Classification.

Yi Hua, Yan Yang, Yuchen Wang, 2019, Molecular pharmaceutics.

ADME properties evaluation in drug discovery: in silico prediction of blood–brain partitioning

Yadong Chen, Yuanrong Fan, Yanmin Zhang, 2018, Molecular Diversity.