Search Result "Molecular Interaction Energies"
Estimation of the Binding Free Energy by Linear Interaction Energy Models
Journal: Mini-Reviews in Medicinal Chemistry
Volume: 12 Issue: 6 Year: 2012 Page: 551-561
Author(s): O. Nicolotti,M. Convertino,F. Leonetti,M. Catto,S. Cellamare,A. Carotti
Exploring Energy Profiles of Protein-Protein Interactions (PPIs) Using DFT Method
Journal: Letters in Drug Design & Discovery
Volume: 16 Issue: 6 Year: 2019 Page: 670-677
Author(s): Sanket Bapat,Renu Vyas,Muthukumarasamy Karthikeyan
Linear Interaction Energy (LIE) Method in Lead Discovery and Optimization
Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1100-1105
Author(s): Hermes Luis Neubauer de Amorim, Rafael Andrade Caceres, Paulo Augusto Netz
The Interaction of Isoflavone Phytoestrogens with ERα and ERβ by Molecular Docking and Molecular Dynamics Simulations
Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 5 Year: 2021 Page: 655-665
Author(s): Ting Wang,Yaquan Liu,Xuming Zhuang,Feng Luan,Chunyan Zhao
General Aspects of Molecular Interaction Fields in Drug Design
Ebook: New Developments in Medicinal Chemistry
Volume: 1 Year: 2010
Author(s): Vinicius Barreto da Silva,Jonathan Resende de Almeida,Carlos Henrique Tomich de Paula da Silva
Doi: 10.2174/978160805127411001010070
Molecular Recognition and Binding Free Energy Calculations in Drug Development
Journal: Current Pharmaceutical Biotechnology
Volume: 9 Issue: 2 Year: 2008 Page: 87-95
Author(s): B. N. Dominy
Prediction and Dissection of Protein-RNA Interactions by Molecular Descriptors
Journal: Current Topics in Medicinal Chemistry
Volume: 16 Issue: 6 Year: 2016 Page: 604-615
Author(s): Zhi-Ping Liu,Luonan Chen
Recent Advances in ProteinâLigand Interactions: Molecular Dynamics Simulations and Binding Free Energy
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 518-531
Author(s): Kshatresh Dutta Dubey,Rakesh Kumar Tiwari,Rajendra Prasad Ojha
Influence of Molecular Stereochemistry on the Continuum Model for Van der Waals Interaction between β-Cyclodextrin and Linear Molecules
Journal: Current Physical Chemistry
Volume: 3 Issue: 3 Year: 2013 Page: 357-365
Author(s): Elena Alvira
Molecular Mechanism of the Affinity Interactions between BAFF and Its Peptides by Molecular Simulations
Journal: Protein & Peptide Letters
Volume: 22 Issue: 11 Year: 2015 Page: 992-999
Author(s): Xuegang Fu,Liyan Xuan,Yuzhe Wang,Jing Wei,Jian Sun