Search Result "KNN-QSAR model"
A 3D-QSAR Study on a Series of Benzimidazole Derivatives Acting as Hepatitis C Virus Inhibitors: Application of kNN-Molecular Field Analysis
Journal: Medicinal Chemistry
Volume: 6 Issue: 2 Year: 2010 Page: 87-90
Author(s): S.P. Gupta, S. Samanta, Vaishali M. Patil
Classification-based QSAR Models for the Prediction of the Bioactivity of ACE-inhibitor Peptides
Journal: Protein & Peptide Letters
Volume: 25 Issue: 11 Year: 2018 Page: 1015-1023
Author(s): Piercosimo Tripaldi,Andrés Pérez-González,Cristian Rojas,Johann Radax,Davide Ballabio,Roberto Todeschini
Ligand Based Validated Comparative Chemometric Modeling and Pharmacophore Mapping of Aurone Derivatives as Antimalarial Agents
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 3 Year: 2013 Page: 417-432
Author(s): Nilanjan Adhikari,Amit Kumar Halder,Chanchal Mondal,Tarun Jha
2-(2-Arylidenehydrazinyl) Thiazol-4(5H)-ones as Epidermal Growth Factor Receptor Inhibitors: A Combined Quantitative Structure Activity Relationship and Pharmacophore Study
Journal: Current Enzyme Inhibition
Volume: 12 Issue: 2 Year: 2016 Page: 137-144
Author(s): Piyush Ghode, Ravi Tripathi, Sanmati K. Jain
Structural Insight for Imidazopyridazines as Malarial Kinase PfPK7 Inhibitors Using QSAR Techniques
Journal: Medicinal Chemistry
Volume: 8 Issue: 4 Year: 2012 Page: 636-648
Author(s): Nitendra K. Sahu,D. V. Kohli
Mechanistic Approach to Explore Isoniazid Derivatives as Antitubercular Agents Using KNN-MF Based-QSAR Analysis, Pharmacophore Modeling and Molecular Docking
Journal: Current Drug Therapy
Volume: 12 Issue: 2 Year: 2017 Page: 97-114
Author(s): Ekta Verma,Shivangi Agarwal,Shailendra Patil,Sushil K. Kashaw,Asmita Gajbhiye
Predictive QSAR Modeling Workflow, Model Applicability Domains, and Virtual Screening
Journal: Current Pharmaceutical Design
Volume: 13 Issue: 3 Year: 2007 Page: 3494-3504
Author(s): Alexander Tropsha, Alexander Golbraikh
3D-QSAR and Docking Studies on a Series of Benzothiadiazine Derivatives as Genotype 1 HCV Polymerase Inhibitors
Journal: Medicinal Chemistry
Volume: 8 Issue: 6 Year: 2012 Page: 1099-1107
Author(s): Vaishali M. Patil, Satya Prakash Gupta, Subeer Samanta, Neeraj Masand
Discovery of Natural Product-Derived 5-HT1A Receptor Binders by Cheminfomatics Modeling of Known Binders, High Throughput Screening and Experimental Validation
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 7 Year: 2015 Page: 685-692
Author(s): Man Luo,Terry-Elinor Reid,Xiang Simon Wang
Variable Selection Methods in QSAR: An Overview
Journal: Current Topics in Medicinal Chemistry
Volume: 8 Issue: 1 Year: 2008 Page: 1606-1627
Author(s): Maykel Perez Gonzalez, Carmen Teran, Liane Saiz-Urra, Marta Teijeira