Scoring functions and their evaluation methods for protein–ligand docking: recent advances and future directions SY Huang, SZ Grinter, X Zou Physical Chemistry Chemical Physics 12 (40), 12899-12908, 2010 | 649 | 2010 |
Challenges, applications, and recent advances of protein-ligand docking in structure-based drug design SZ Grinter, X Zou Molecules 19 (7), 10150-10176, 2014 | 252 | 2014 |
An inverse docking approach for identifying new potential anti-cancer targets SZ Grinter, Y Liang, SY Huang, SM Hyder, X Zou Journal of Molecular Graphics and Modelling 29 (6), 795-799, 2011 | 87 | 2011 |
Iterative knowledge-based scoring functions derived from rigid and flexible decoy structures: evaluation with the 2013 and 2014 CSAR benchmarks C Yan, SZ Grinter, BR Merideth, Z Ma, X Zou Journal of chemical information and modeling 56 (6), 1013-1021, 2016 | 27 | 2016 |
Inclusion of the orientational entropic effect and low‐resolution experimental information for protein–protein docking in Critical Assessment of PRedicted Interactions (CAPRI) SY Huang, C Yan, SZ Grinter, S Chang, L Jiang, X Zou Proteins: Structure, Function, and Bioinformatics 81 (12), 2183-2191, 2013 | 20 | 2013 |
Automated large-scale file preparation, docking, and scoring: Evaluation of ITScore and STScore using the 2012 community structure–activity resource benchmark SZ Grinter, C Yan, SY Huang, L Jiang, X Zou Journal of chemical information and modeling 53 (8), 1905-1914, 2013 | 20 | 2013 |
Multiscale generalized born modeling of ligand binding energies for virtual database screening HY Liu, SZ Grinter, X Zou The journal of physical chemistry B 113 (35), 11793-11799, 2009 | 18 | 2009 |
Performance of MDockPP in CAPRI rounds 28‐29 and 31‐35 including the prediction of water‐mediated interactions X Xu, L Qiu, C Yan, Z Ma, SZ Grinter, X Zou Proteins: Structure, Function, and Bioinformatics 85 (3), 424-434, 2017 | 16 | 2017 |
A Bayesian statistical approach of improving knowledge‐based scoring functions for protein–ligand interactions SZ Grinter, X Zou Journal of computational chemistry 35 (12), 932-943, 2014 | 14 | 2014 |
Complex pore spaces create record-breaking methane storage system for natural-gas vehicles P Pfeifer, L Aston, M Banks, S Barker, J Burress, S Carter, J Coleman, ... Chaos: An Interdisciplinary Journal of Nonlinear Science 17 (4), 2007 | 14 | 2007 |
Modulating the voltage sensor of a cardiac potassium channel shows antiarrhythmic effects Y Lin, SZ Grinter, Z Lu, X Xu, HZ Wang, H Liang, P Hou, J Gao, C Clausen, ... Proceedings of the National Academy of Sciences 118 (20), e2024215118, 2021 | 8 | 2021 |
Oxidosqualene cyclase as a protein target for anticancer therapeutics SM Hyder, Y Liang, X Zou, SZ Grinter, S Huang US Patent 10,143,686, 2018 | 1 | 2018 |
Modeling Protein-Ligand Interactions with Applications to Drug Design SZ Grinter University of Missouri--Columbia, 2014 | | 2014 |
A Bayesian Statistical Approach for Improving Scoring Functions for Protein-Ligand Interactions SZ Grinter, X Zou APS March Meeting Abstracts 2013, Y46. 007, 2013 | | 2013 |
Exercise on 2011 CSAR Benchmark using the iterative knowledge-based scoring functions ITScore and STScore of the MDock software: What we have learned SY Huang, SZ Grinter, C Yan, L Jiang, X Zou ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012 | | 2012 |
Improving the Accuracy of Knowledge-Based Scoring Functions for Protein-Ligand Interactions by Accounting for Sparse Data in the Training Set SZ Grinter, X Zou Biophysical Journal 102 (3), 409a, 2012 | | 2012 |
Industrial process design and cost analysis for the production of a specific activated carbon S Grinter, JT Vassalli University of Missouri--Columbia. Office of Undergraduate Research, 2006 | | 2006 |
Industrial process design and cost analysis for the production of a specific activated carbon [Vassalli abstract] JT Vassalli, S Grinter University of Missouri--Columbia. Office of Undergraduate Research, 2006 | | 2006 |