Search Result "molecular modelling data"


Molecular Modeling of Flavonoid-β-Cyclodextrin Complexes

Journal: Letters in Drug Design & Discovery
Volume: 5 Issue: 8 Year: 2008 Page: 512-520
Author(s): Ying Zheng, Albert H.L. Chow, Ian S. Haworth

Molecular Modeling Used to Evaluate CYP2C9-Dependent Metabolism: Homology Modeling, Molecular Dynamics and Docking Simulations

Journal: Current Drug Metabolism
Volume: 12 Issue: 6 Year: 2011 Page: 533-548
Author(s): Jessica E. Mendieta-Wejebe, Jose Correa-Basurto, Erika M. Garcia-Segovia, Gisela Ceballos-Cancino, Martha C. Rosales-Hernandez

The Utility of Molecular Sequence Data in Phylogenetic Analysis of Bryoflora

Ebook: Recent Advances in Botanical Science
Volume: 1 Year: 2020
Author(s): Saumya Pandey,Afroz Alam

Pharmacological Classification of Drugs Based on Neural Network Processing of Molecular Modeling Data

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 3 Issue: 6 Year: 2000 Page: 525-533
Author(s): Adam Bucinski, Antoni Nasal, Roman Kaliszan

Review Article

Molecular Modeling Approaches for the Prediction of Selected Pharmacokinetic Properties

Journal: Current Topics in Medicinal Chemistry
Volume: 18 Issue: 2 Year: 2018 Page: 2230-2238
Author(s): Emilio S. Petito,David J.R. Foster,Michael B. Ward,Matthew J. Sykes

The Challenges Involved in Modeling Toxicity Data In Silico: A Review

Journal: Current Pharmaceutical Design
Volume: 18 Issue: 9 Year: 2012 Page: 1266-1291
Author(s): M. Paul Gleeson, Sandeep Modi, Andreas Bender, Richard L. Marchese Robinson, Johannes Kirchmair, Malinee Promkatkaew, Supa Hannongbua, Robert C. Glen

Research Article

Computational Methods and Molecular Modelling for Some Predicted Tautomers of Pyrimidine Compounds

Journal: Current Chinese Chemistry
Volume: 1 Issue: 0 Year: 2021 Page: 1-20
Author(s): Mamdouh S. Masoud,Marwa Y. Abd El-Kaway

Influence of HPLC Retention Data and Molecular Modeling Descriptors on Prediction of Pharmacological Classification of Drugs Using Principal Component Analysis Method

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 13 Issue: 9 Year: 2010 Page: 765-776
Author(s): Marcin Koba, Leszek Bober, Urszula Judycka-Proma, Tomasz Baczek

Molecular Modeling as a Tool for Drug Discovery

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1084-1091
Author(s): Guy Barros Barcellos, Ivani Pauli, Rafael Andrade Caceres, Luis Fernando Saraiva Macedo Timmers, Raquel Dias, Walter Filgueira de Azevedo Jr

Molecular Modeling of Melanocortin Receptors

Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2007 Page: 1042-1051
Author(s): Hongmao Sun, David Fry

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