Search Result "linear free-energy relationship"


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

Linear Free Energy Relationship Analysis of Solvent Effects on Singlet Oxygen Reactions

Journal: Current Organic Chemistry
Volume: 7 Issue: 9 Year: 2003 Page: 799-819
Author(s): Else Lemp, Antonio L. Zanocco, Eduardo A. Lissi

Advances in Binding Free Energies Calculations: QM/MM-Based Free Energy Perturbation Method for Drug Design

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 26 Year: 2013 Page: 4674-4686
Author(s): R.S. Rathore,M. Sumakanth,M. Siva Reddy,P. Reddanna,Allam Appa Rao,Mark D. Erion,M.R. Reddy

Overview of Binding Free Energy Calculation Techniques for Elucidation of Biological Processes and for Drug Discovery

Journal: Medicinal Chemistry
Volume: 11 Issue: 3 Year: 2015 Page: 248-253
Author(s): Takeshi Ashida, Takeshi Kikuchi

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

Role of Long-Range Contacts and Structural Classification in Understanding the Free Energy of Unfolding of Two-State Proteins

Journal: Current Bioinformatics
Volume: 7 Issue: 2 Year: 2012 Page: 143-151
Author(s): Balasubramanian Hariha,Samuel Selvaraj

Identification of HIV Inhibitors Guided by Free Energy Perturbation Calculations

Journal: Current Pharmaceutical Design
Volume: 18 Issue: 9 Year: 2012 Page: 1199-1216
Author(s): Orlando Acevedo, Zandrea Ambrose, Patrick T. Flaherty, Hadega Aamer, Prashi Jain, Somisetti V. Sambasivarao

Mini-Review Article

Molecular Descriptors and QSSR Models in Asymmetric Catalysis

Journal: Mini-Reviews in Organic Chemistry
Volume: 19 Issue: 8 Year: 2022 Page: 933-938
Author(s):

Non-linear Optics

Ebook: Fluorescence Microscopy in Life Sciences
Volume: 1 Year: 2017
Author(s): Juan Carlos Stockert,Alfonso Blazquez-Castro
Doi: 10.2174/9781681085180117010023

Computational Modelling of Linear Motif-Mediated Protein Interactions

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 14 Year: 2012 Page: 1553-1561
Author(s): Bostjan Kobe,Mikael Boden

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