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Sam Z. Grinter
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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
6282010
Challenges, applications, and recent advances of protein-ligand docking in structure-based drug design
SZ Grinter, X Zou
Molecules 19 (7), 10150-10176, 2014
2312014
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
852011
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
282016
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
192013
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
192013
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
182009
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
152017
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
142014
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
132007
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
62021
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
12018
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
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Artikelen 1–18