Role of Water in Ligand Binding to Maltose-Binding Protein: Insight From a New Docking Protocol Based on the 3d-Rism-Kh Molecular Theory of Solvation

Journal of Chemical Information and Modeling - United States
doi 10.1021/ci500520q
Full Text
Abstract

Available in full text

Date
Authors
Publisher

American Chemical Society (ACS)

Related search

Selective Ion-Binding by Protein Probed With the 3d-Rism Theory

English

Two Modes of Ligand Binding in Maltose-Binding Protein ofEscherichia Coli

Journal of Biological Chemistry
BiochemistryCell BiologyMolecular Biology
1997English

Predicting the Binding Mode of 2Hydroxypropyl--Cyclodextrin to Cholesterol by Means of the MD Simulation and the 3d-Rism-Kh Theory

English

Accurate Prediction of Protein-Ligand Binding by Combined Molecular Dynamics-Based Docking and QM/MM Methods

Biophysical Journal
Biophysics
2018English

Minimalistic Predictor of Protein Binding Energy: Contribution of Solvation Factor to Protein Binding

Biophysical Journal
Biophysics
2015English

Intriguing Role of Water in Protein-Ligand Binding Studied by Neutron Crystallography on Trypsin Complexes

Nature Communications
AstronomyGeneticsMolecular BiologyBiochemistryChemistryPhysics
2018English

Docking Studies on Cyclooxygenases-2 Inhibitors Based on Potential Ligand Binding Sites

International Journal of Computer Applications
2014English

Role of Desolvation in Thermodynamics and Kinetics of Ligand Binding to a Protein

Biophysical Journal
Biophysics
2015English

Membrane Binding of Synaptotagmin-Like Protein 4: Insight From Molecular Dynamics Simulations

Biophysical Journal
Biophysics
2019English

Amanote Research

Note-taking for researchers

Follow Amanote

© 2024 Amaplex Software S.P.R.L. All rights reserved.

Privacy PolicyRefund Policy