Search Result "Polarisable continuum model"


Considering the Medium when Studying Biologically Active Molecules: Motivation, Options and Challenges

Ebook: Frontiers in Computational Chemistry
Volume: 1 Year: 2015
Author(s): Liliana Mammino,Mwadham M. Kabanda
Doi: 10.2174/9781608058648115010008

Mechanism of Action of D-Xylose Isomerase

Journal: Current Protein & Peptide Science
Volume: 1 Issue: 3 Year: 2000 Page: 237-254
Author(s): B. Asboth, G. Naray-Szabo

Possible Origins of Biohomochirality

Journal: Current Chemical Biology
Volume: 1 Issue: 1 Year: 2007 Page: 41-52
Author(s): Daniel Fitz, Hannes Reiner, Kristof Plankensteiner, Bernd Michael Rode

New Insights on Flavonoid-Serum Albumin Interactions from Concerted Spectroscopic Methods and Molecular Modeling

Journal: Current Drug Metabolism
Volume: 14 Issue: 4 Year: 2013 Page: 474-490
Author(s): Sorana Ionescu, Iulia Matei, Cristina Tablet, Mihaela Hillebrand

QSAR Analysis of Compounds Exhibiting General Anesthetics’ Properties

Journal: Letters in Drug Design & Discovery
Volume: 9 Issue: 6 Year: 2012 Page: 595-603
Author(s): Leszek Bober,Piotr Kawczak,Tomasz Baczek

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

Catalytic Effect of Organoaluminium Chloride Reagents on the Dienophilic Reactivity of Indolizine and 2-Phosphaindolizine towards [2+4] Cycloaddition: A DFT Investigation

Journal: Current Catalysis
Volume: 1 Issue: 2 Year: 2012 Page: 93-99
Author(s): Neelima Gupta,Rajendra K. Jangid,Raj K. Bansal,Moritz von Hopffgarten

Subject Index

Ebook: Frontiers in Computational Chemistry
Volume: 1 Year: 2015
Author(s): Zaheer-ul-Haq,J. D. Madura
Doi: 10.2174/9781608058648115010011

Discovery of a Statistically Significant and Interpretable Relationship Between Redox Reactivity and Lethality of Drugs

Journal: Current Drug Metabolism
Volume: 14 Issue: 7 Year: 2013 Page: 738-744
Author(s): Siu-Kwong Pang

Role of Inflammatory Cells and Toll-Like Receptors in Atherosclerosis

Journal: Current Vascular Pharmacology
Volume: 13 Issue: 2 Year: 2015 Page: 146-160
Author(s): Anusha N. Seneviratne,Claudia Monaco

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