Search Result "continuum solvent model"
Modelling the Effect of Solvents on Carbohydrates
Journal: Mini-Reviews in Organic Chemistry
Volume: 8 Issue: 3 Year: 2011 Page: 249-255
Author(s): Vojtech Spiwok, Alfred D. French
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
Application of a Continuum Mean Field Approximation to Fullerenes in Lipid Bilayers
Journal: Current Nanoscience
Volume: 7 Issue: 5 Year: 2011 Page: 667-673
Author(s): R. J.K. Udayana Ranatunga, Steven O. Nielsen
Solvation Models: Theory and Validation
Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3266-3280
Author(s): Enrico O. Purisima,Traian Sulea
Modeling of HIV-1 TAR RNA-Ligand Complexes
Journal: Medicinal Chemistry
Volume: 7 Issue: 4 Year: 2011 Page: 301-308
Author(s): Petar M. Mitrasinovic, Jyoti S. Tomar, Maya S. Nair, Ritu Barthwal
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
Influence of Polarity on the Scalability and Reproducibility of Solvent-Free Microwave-Assisted Reactions
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 2 Year: 2011 Page: 109-116
Author(s): Angel Diaz-Ortiz, Antonio de la Hoz, Jesus Alcazar, Jose R. Carrillo, Maria A. Herrero, Alberto Fontana, Juan de M. Munoz, Pilar Prieto, Abel de Cozar
α-Pinene Conversion to Terpineol and Other Derivatives: Molecular Modeling and Infrared Mechanistic Study
Journal: Current Physical Chemistry
Volume: 8 Issue: 3 Year: 2018 Page: 211-221
Author(s): Lienda Handojo,Yonas Mulyadi,Jessica Suryajaya,Yansen Hartanto,Antonius Indarto
Exploring Protein-Protein and Protein-Ligand Interactions in the Immune System using Molecular Dynamics and Continuum Electrostatics
Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 324-343
Author(s): Chris A. Kieslich,Phanourios Tamamis,Ronald D. Gorham Jr.,Aliana Lopez de Victoria,Noriko U. Sausman,Georgios Archontis,Dimitrios Morikis
In Silico Screening of Bioactive and Biomimetic Solutes Using Molecular Integral Equation Theory
Journal: Current Pharmaceutical Design
Volume: 17 Issue: 1 Year: 2011 Page: 1695-1708
Author(s): David S. Palmer, Gennady N. Chuev, Ekaterina L. Ratkova, Maxim V. Fedorov