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The Number of Scholarly Documents on the Public Web
published 09 May 2014
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Quercetin as a potential treatment for COVID-19-induced acute kidney injury: Based on network pharmacology and molecular docking study
published 14 Jan 2021
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Systematic Validation of Protein Force Fields against Experimental Data
published 22 Feb 2012
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Ligand Pose and Orientational Sampling in Molecular Docking
published 01 Oct 2013
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Human Lactate Dehydrogenase A Inhibitors: A Molecular Dynamics Investigation
published 17 Jan 2014
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The Molecular Mechanism of Bisphenol A (BPA) as an Endocrine Disruptor by Interacting with Nuclear Receptors: Insights from Molecular Dynamics (MD) Simulations
published 23 Mar 2015
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Molecular Basis of NDM-1, a New Antibiotic Resistance Determinant
published 24 Aug 2011
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Comparative genome analysis of novel coronavirus (SARS-CoV-2) from different geographical locations and the effect of mutations on major target proteins: An in silico insight
published 03 Sep 2020
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A Novel Approach of Dynamic Cross Correlation Analysis on Molecular Dynamics Simulations and Its Application to Ets1 Dimer–DNA Complex
published 07 Nov 2014
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Predicting opioid receptor binding affinity of pharmacologically unclassified designer substances using molecular docking
published 24 May 2018
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Rapid and Accurate Prediction and Scoring of Water Molecules in Protein Binding Sites
published 01 Mar 2012
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Effects of Dimethyl Sulfoxide in Cholesterol-Containing Lipid Membranes: A Comparative Study of Experiments In Silico and with Cells
published 25 Jul 2012
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Going beyond Clustering in MD Trajectory Analysis: An Application to Villin Headpiece Folding
published 15 Apr 2010
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