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Predicting the Metabolic Pathways of Small Molecules Based on Their Physicochemical Properties

Journal: Protein & Peptide Letters
Volume: 19 Issue: 12 Year: 2012 Page: 1250-1256
Author(s): Chun-Rong Peng,Wen-Cong Lu,Bing Niu,Min-Jie Li,Xiao-YanYang,Mi-Lin Wu

QSAR and Pharmacophore Study of Dyrk1A Inhibitory Meridianin Analogs as Potential Agents for Treatment of Neurodegenerative Diseases

Journal: Medicinal Chemistry
Volume: 9 Issue: 1 Year: 2013 Page: 152-161
Author(s): Sandip B. Bharate, Rammohan R. Yadav, Ram A. Vishwakarma

QSAR and Pharmacophore Modeling of Natural and Synthetic Antimalarial Prodiginines

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 3 Year: 2013 Page: 350-359
Author(s): Baljinder Singh,Ram A. Vishwakarma,Sandip B. Bharate

Small Molecules' Multi-Metabolic Pathways Prediction Using Physico- Chemical Features and Multi-Task Learning Method.

Journal: Current Bioinformatics
Volume: 8 Issue: 5 Year: 2013 Page: 564-568
Author(s): Bing Niu,Lei Gu,Chunrong Peng,Juan Ding,Xiaochen Yuan,Wencong Lu

Review Article

Emerging Need of Today: Significant Utilization of Various Databases and Softwares in Drug Design and Development

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 21 Issue: 8 Year: 2021 Page: 1025-1032
Author(s): Neema Bisht,Archana N. Sah,Sandeep Bisht,Himanshu Joshi

Research Article

Chemoinformatics Profiling of the Chromone Nucleus as a MAO-B/A2AAR Dual Binding Scaffold

Journal: Current Neuropharmacology
Volume: 15 Issue: 8 Year: 2017 Page: 1117-1135
Author(s): Maykel Cruz-Monteagudo,Fernanda Borges,M.Natalia D. S. Cordeiro,Aliuska Morales Helguera,Eduardo Tejera,Cesar Paz-y-Mino,Aminael Sanchez-Rodriguez,Yunier Perera-Sardina,Yunierkis Perez-Castillo

Research Article

Quantitative Structure-activity Relationship of Acetylcholinesterase Inhibitors based on mRMR Combined with Support Vector Regression

Journal: Letters in Organic Chemistry
Volume: 16 Issue: 4 Year: 2019 Page: 311-316
Author(s): Jiaxiang Wu,Guozhao Mai,Bowen Deng,Jeong Younseo,Dongsu Du,Fuxue Chen,Qiaorong Ma

Chemical Informatics and the Drug Discovery Knowledge Pyramid

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 16 Issue: 1 Year: 2013 Page: 764-776
Author(s): Gerald H. Lushington, Yinghua Dong, Bhargav Theertham

A Survey of Quantitative Descriptions of Molecular Structure

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 18 Year: 2012 Page: 1946-1956
Author(s): Rajarshi Guha,Egon Willighagen

The PI and Edge Szeged Indices of One-Heptagonal Carbon Nanocones

Journal: Current Nanoscience
Volume: 5 Issue: 1 Year: 2009 Page: 51-53
Author(s): Ali Reza Ashrafi, Farzaneh Gholami-Nezhaad

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