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Small Molecule Databases and Chemical Descriptors Useful in Chemoinformatics: An Overview

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 6 Year: 2011 Page: 548-558
Author(s): Rafael Gozalbes, Antonio Pineda-Lucena

Structural Protein Descriptors in 1-Dimension and their Sequence-Based Predictions

Journal: Current Protein & Peptide Science
Volume: 12 Issue: 6 Year: 2011 Page: 470-489
Author(s): Lukasz Kurgan, Fatemeh Miri Disfani

Quantitative Structure-Activity Relationships for Anticancer Activity of 2- Phenylindoles Using Mathematical Molecular Descriptors

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 98-108
Author(s): Subhash C. Basak, Qianhong Zhu, Denise Mills

Understanding the Diels-Alder Reactivity of Superelectrophilic Nitrobenzofuroxans and Related 10π-Heteroaromatics through DFT-Based Electrophilicity Descriptors

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 108-118
Author(s): Sami Lakhdar, Guillaume Berionni, Regis Goumont, Francois Terrier

QSAR Analysis of Isosteviol Derivatives as α-Glucosidase Inhibitors with Element Count and Other Descriptors

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 1 Year: 2011 Page: 14-25
Author(s): N. S. Hari Narayana Moorthy, Maria J. Ramos, Pedro A. Fernandes

Receptor-Based Pharmacophore and Pharmacophore Key Descriptors for Virtual Screening and QSAR Modeling

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 3 Year: 2011 Page: 181-189
Author(s): Xialan Dong, Jerry O. Ebalunode, Sheng-Yong Yang, Weifan Zheng

Molecular Surface Representation Using 3D Zernike Descriptors for Protein Shape Comparison and Docking

Journal: Current Protein & Peptide Science
Volume: 12 Issue: 6 Year: 2011 Page: 520-530
Author(s): Daisuke Kihara, Lee Sael, Rayan Chikhi, Juan Esquivel-Rodriguez

QSAR Study on 5-Lipoxygenase Activating Protein (FLAP) Inhibitors: The Derivatives of 2,2-Bisaryl-Bicycloheptane

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 1 Year: 2011 Page: 32-43
Author(s): Brij Kishore Sharma, Pradeep Pilania, Prithvi Singh

Volsurf Descriptors to Analyse Anti-HCV and Cytotoxic Activities of Sesquiterpene Lactones from Asteraceae Family

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 1 Year: 2011 Page: 44-58
Author(s): Mariane Ballerini Fernandes, Michelle Rossini, Ricardo Stefani, Leoberto Tavares, Vicente de Paulo Emerenciano, Luciana Scotti, Marcelo Sobral da Silva, Marcus Tullius Scotti

Numerical Descriptors for the Characterization of Chiral Compounds and their Applications in Modeling Biological and Toxicological Activities

Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 7 Year: 2011 Page: 771-787
Author(s): Ramanathan Natarajan, Subhash C. Basak

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