Search Result "AMBER 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
Electrostatic Fields
Ebook: Electromagnetics for Engineering Students Part I
Volume: 1 Year: 2017
Author(s): Sameir M. Ali Hamed
Doi: 10.2174/9781681085043117010004
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
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.
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
Molecular Dynamics Simulation and DFT Study to Predict the Refractive Index of Intermediates in the Paal-Knorr Pyrrole Synthesis
Journal: Letters in Organic Chemistry
Volume: 14 Issue: 2 Year: 2017 Page: 120-127
Author(s): Mohsen Sargolzaei,Esmaiel Soleimani,Mahdi Afshar
Molecular Dynamics Simulations, Challenges and Opportunities: A Biologistâs 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
Computational Investigation on the MDM2-Idasanutlin Interaction Using the Potential of Mean Force Method
Journal: Current Chemical Biology
Volume: 15 Issue: 3 Year: 2021 Page: 262-270
Author(s): Pundarikaksha Das,Venkata Satish Kumar Mattaparthi
Study of Interactions of Nucleoside Anticancer Drugs, Capecitabine andGemcitabine, with SWNT and BNNT using Molecular and QuantumMechanical Calculations
Journal: Letters in Organic Chemistry
Volume: 21 Issue: 3 Year: 2024 Page: 238-254
Author(s):
Enzyme-Substrate Binding Interaction Energies and Their Application to the Cytochrome P450 System
Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 2 Year: 2008 Page: 111-122
Author(s): David F.V. Lewis, Yuko Ito, Peter S. Goldfarb