Search Result "force-field"


Molecular Mechanics Force Fields and their Applications in Drug Design

Journal: Anti-Infective Agents in Medicinal Chemistry
Volume: 8 Issue: 2 Year: 2009 Page: 128-150
Author(s): Raghuvir R.S. Pissurlenkar, Mushtaque S. Shaikh, Radhakrishnan P. Iyer, Evans C. Coutinho

A Novel Coarse-Grained Description of Protein Structure and Folding by UNRES Force Field and Discrete Nonlinear Schrödinger Equation

Ebook: Frontiers in Computational Chemistry
Volume: 1 Year: 2015
Author(s): Adam Liwo,Antti Niemi,Xubiao Peng,Adam K. Sieradzan
Doi: 10.2174/9781608058648115010009

Research Article

Development of an Information System of Structures and Force Field Parameters of Chemical Compounds from Sri Lankan Flora

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 21 Issue: 8 Year: 2018 Page: 550-556
Author(s): Samith Rathnayake,Samantha Weerasinghe

Molecular Mechanics

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3281-3292
Author(s): Kenno Vanommeslaeghe,Olgun Guvench,Alexander D. MacKerell Jr.

Atomic Force and Scanning Near-Field Optical Microscopy Study of Carbocyanine Dye J-aggregates

Journal: Current Nanoscience
Volume: 10 Issue: 5 Year: 2014 Page: 700-704
Author(s): V.V. Prokhorov, M.G. Petrova, N.N. Kovaleva, E.I. Demikhov

Research Article

Identifying Native and Non-native Membrane Protein Loops by Using Stabilizing Energetic Terms of Three Popular Force Fields

Journal: Current Chinese Science
Volume: 1 Issue: 1 Year: 2021 Page: 14-21
Author(s): Konda Mani Saravanan,Haiping Zhang,Yanjie Wei

Biomolecular Simulations of Metalloenzymes: Strategies to Tackle the Missing Parameter Problem

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 2 Issue: 3 Year: 2012 Page: 254-262
Author(s): Alexandra T.P. Carvalho

Review Article

Molecular Dynamics Simulations, Challenges and Opportunities: A Biologist’s Prospective

Journal: Current Protein & Peptide Science
Volume: 18 Issue: 11 Year: 2017 Page: 1163-1179
Author(s): Indu Kumari,Padmani Sandhu,Mushtaq Ahmed,Yusuf Akhter

Structural and Vibrational Investigation on a Benzoxazin Derivative with Potential Antibacterial Activity

Ebook: Frontiers in Computational Chemistry
Volume: 2 Year: 2015
Author(s): María V. Castillo,Elida Romano,Ana B. Raschi,Silvia A. Brandán
Doi: 10.2174/9781608059782115020008

Emerging Physics for Gravity-Like Fields

Ebook: Gravity-Superconductors Interactions: Theory and Experiment
Volume: 1 Year: 2012
Author(s): Walter Dröscher,Jochem Hauser
Doi: 10.2174/978160805399511201010229

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