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Assessing protein–ligand interaction scoring functions with the CASF-2013 benchmarkLi, Yan; Su, Minyi; Liu, Zhihai; Li, Jie; Liu, Jie; Han, Li; Wang, Renxiao · Nature Protocols · 2018
Cross-Mapping of Protein - Ligand Binding Data Between ChEMBL and PDBbindLiu, Zhihai; Li, Jie; Liu, Jie; Liu, Yuchen; Nie, Wei; Han, Li; Li, Yan; Wang, Renxiao · Molecular Informatics · 2015
Forging the Basis for Developing Protein–Ligand Interaction Scoring FunctionsLiu, Zhihai; Su, Minyi; Han, Li; Liu, Jie; Yang, Qifan; Li, Yan; Wang, Renxiao · Accounts of Chemical Research · 2017
Mining the Characteristic Interaction Patterns on Protein–Protein Binding InterfacesLi, Yan; Liu, Zhihai; Han, Li; Li, Chengke; Wang, Renxiao · Journal of Chemical Information and Modeling · 2013
Comparative Assessment of Scoring Functions on a Diverse Test SetCheng, Tiejun; Li, Xun; Li, Yan; Liu, Zhihai; Wang, Renxiao · Journal of Chemical Information and Modeling · 2009
A Statistical Survey on the Binding Constants of Covalently Bound Protein–Ligand ComplexesXun Li; Zhihai Liu; Yan Li; Jie Li; Jiajie Li; Renxiao Wang · 2010
Comparative Assessment of Scoring Functions: The CASF-2016 UpdateSu, Minyi; Yang, Qifan; Du, Yu; Feng, Guoqin; Liu, Zhihai; Li, Yan; Wang, Renxiao · Journal of Chemical Information and Modeling · 2018
Comparative Assessment of Scoring Functions on an Updated Benchmark: 1. Compilation of the Test SetLi, Yan; Liu, Zhihai; Li, Jie; Han, Li; Liu, Jie; Zhao, Zhixiong; Wang, Renxiao · Journal of Chemical Information and Modeling · 2014
The Generation of FullerenesBrinkmann, Gunnar; Goedgebeur, Jan; McKay, Brendan D. · Journal of Chemical Information and Modeling · 2012
ACD/Spectrus Processor ReviewKwan, Eugene E. · Journal of Chemical Information and Modeling · 2012
Modeling Robust QSAR <sup>†</sup>Polanski, Jaroslaw; Bak, Andrzej; Gieleciak, Rafal; Magdziarz, Tomasz · Journal of Chemical Information and Modeling · 2006
Morgan revisitedFigueras, John · Journal of Chemical Information and Modeling · 1993
A Marine Natural Product DatabaseLei, J.; Zhou, J. · Journal of Chemical Information and Modeling · 2002
Chemical Structure and SuperconductivityKing, R.B. · Journal of Chemical Information and Modeling · 1999
Chemoisosterism in the ProteomeJalencas, Xavier; Mestres, Jordi · Journal of Chemical Information and Modeling · 2013
CHEMTEXTWolman, Yecheskel · Journal of Chemical Information and Modeling · 1988