Search Result "coupling continuum and atomistic method"


Atomistic Models for Free Energy Evaluation of Drug Binding to Membrane Proteins

Journal: Current Medicinal Chemistry
Volume: 18 Issue: 1 Year: 2011 Page: 2601-2611
Author(s): S. Durdagi, C. Zhao, J. E. Cuervo, S. Y. Noskov

Multiscale Analysis of MNT

Ebook: Micro and Nanomachining Technology-Size, Model and Complex Mechanism
Volume: 1 Year: 2014
Author(s): Xuesong Han
Doi: 10.2174/9781608057696114010007

Quantum Chemical Methods for Calculation of Non-Covalent Interactions in Biological Molecules

Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 314-323
Author(s): Sarah Aldulaijan,James A. Platts

Membranes Coupled with Nanotechnology for Drinking Water: An Overview

Journal: Current Biotechnology
Volume: 1 Issue: 1 Year: 2012 Page: 42-71
Author(s): Kelvii Wei Guo

Molecular Dynamics Simulation of MNT

Ebook: Micro and Nanomachining Technology-Size, Model and Complex Mechanism
Volume: 1 Year: 2014
Author(s): Xuesong Han
Doi: 10.2174/9781608057696114010005

Simplified Computational Methods for the Analysis of Protein Flexibility

Journal: Current Protein & Peptide Science
Volume: 10 Issue: 6 Year: 2009 Page: 607-613
Author(s): Igor B. Kuznetsov

Quantum Mechanical Methods for Drug Design

Journal: Current Topics in Medicinal Chemistry
Volume: 10 Issue: 1 Year: 2010 Page: 33-45
Author(s): Ting Zhou, Danzhi Huang, Amedeo Caflisch

Current State-of-the-art for Virtual Screening and Docking Methods

Ebook: New Developments in Medicinal Chemistry
Volume: 2 Year: 2014
Author(s): Carlton Anthony Taft,Carlos Henrique Tomich de Paula da Silva
Doi: 10.2174/9781608059546114020004

Binding Affinity and Specificity from Computational Studies

Journal: Current Organic Chemistry
Volume: 6 Issue: 1 Year: 2002 Page: 1319-1332
Author(s): Themis Lazaridis

Application of Multi-scale Modeling Techniques in System Biology

Ebook: Systems Biology, Bioinformatics and Livestock Science
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815165616123010007

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