Search Result "QSAR modeling"


Research Article

Development and Validation of a Robust QSAR Model for Benzothiazole Hydrazone Derivatives as Bcl-XL Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 16 Issue: 1 Year: 2019 Page: 11-20
Author(s): Pawan Gupta,Aleksandrs Gutcaits

Research Article

QSAR Models for Predicting Aquatic Toxicity of Esters Using Genetic Algorithm-Multiple Linear Regression Methods

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 22 Issue: 5 Year: 2019 Page: 317-325
Author(s): Mehdi Rajabi,Fatemeh Shafiei

Research Article

Image-based QSAR Model for the Prediction of P-gp Inhibitory Activity of Epigallocatechin and Gallocatechin Derivatives

Journal: Current Computer-Aided Drug Design
Volume: 15 Issue: 3 Year: 2019 Page: 212-224
Author(s): Paria Ghaemian,Ali Shayanfar

Research Article

Discovery of New Phosphoinositide 3-kinase Delta (PI3Kδ) Inhibitors via Virtual Screening using Crystallography-derived Pharmacophore Modelling and QSAR Analysis

Journal: Medicinal Chemistry
Volume: 15 Issue: 6 Year: 2019 Page: 586-599
Author(s): Mahmoud A. Al-Sha`er,Rua`a A. Al-Aqtash,Mutasem O. Taha

Research Article

QSAR and Docking Studies of DATA Analogues as HIV-1 Reverse Transcriptase Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 16 Issue: 2 Year: 2019 Page: 153-159
Author(s): Jianbo Tong,Shan Lei,Pei Shan,Shangshang Qin,Yang Wang

Research Article

DFT-Based QSAR Modelling of Inhibitory Activity of Coumarins and Sulfocoumarins on Carbonic Anhydrase (CA) Isoforms (CA I and CA II)

Journal: Current Computer-Aided Drug Design
Volume: 15 Issue: 3 Year: 2019 Page: 243-251
Author(s): Erol Eroglu

Research Article

QSAR Analysis of Multimodal Antidepressants Vortioxetine Analogs Using Physicochemical Descriptors and MLR Modeling

Journal: Current Computer-Aided Drug Design
Volume: 15 Issue: 4 Year: 2019 Page: 294-307
Author(s): David M. Rajathei,Subbiah Parthasarathy,Samuel Selvaraj

Research Article

QSAR and Docking Studies on Piperidyl-cyclohexylurea Derivatives for Prediction of Selective and Potent Inhibitor of Matriptase

Journal: Current Computer-Aided Drug Design
Volume: 15 Issue: 2 Year: 2019 Page: 167-181
Author(s): Agha Zeeshan Mirza,Hina Shamshad

Research Article

QSAR Study of Some 1,3-Oxazolylphosphonium Derivatives as New Potent Anti-Candida Agents and Their Toxicity Evaluation

Journal: Current Drug Discovery Technologies
Volume: 16 Issue: 2 Year: 2019 Page: 204-209
Author(s): Maria M. Trush,Vasyl Kovalishyn,Alla D. Ocheretniuk,Oleksandr L. Kobzar,Maryna V. Kachaeva,Volodymyr S. Brovarets,Larisa O. Metelytsia

Research Article

In-Silico QSAR Modelling of Predicted Rho Kinase Inhibitors Against Cardio Vascular Diseases

Journal: Current Computer-Aided Drug Design
Volume: 15 Issue: 5 Year: 2019 Page: 421-432
Author(s): Seema Kesar,Sarvesh Paliwal,Swapnil Sharma,Pooja Mishra,Monika Chauhan,Richa Arya,Kirtika Madan,Shagufta Khan

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