Search Result "3D-QSAR"


Research Article

Design and Prediction of ADME/Tox Properties of Novel Magnolol Derivativesas Anticancer Agents for NSCLC Using 3D-QSAR, Molecular Docking,MOLCAD and MM-GBSA Studies

Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 5 Year: 2023 Page: 545-569
Author(s):

Research Article

Structural Optimization for 4-hydroxyphenylpyruvate Dioxygenase InhibitorsBased on 3D-QSAR, Molecular Docking, SBP Modeling andMOLCAD Studies

Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 12 Year: 2023 Page: 1922-1935
Author(s):

Research Article

Assessment of Structural Basis for Thiazolopyridine Derivatives as DNAGyrase-B Inhibitors

Journal: Current Drug Discovery Technologies
Volume: 20 Issue: 4 Year: 2023 Page: 1-23
Author(s): Vishal Prakash Zambre,Nilesh Narayan Petkar,Vishal Pravin Dewoolkar,Swapnali Vilas Bhadke,Sanjay Dinkar Sawant

Research Article

A Rational Approach to Anticancer Drug Design: 2D and 3D- QSAR,Molecular Docking and Prediction of ADME Properties Using SilicoStudies of Thymidine Phosphorylase Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 2 Year: 2023 Page: 153-166
Author(s): Vaibhav V. Raut,Shashikant V. Bhandari,Shital M. Patil,Aniket P. Sarkate

Research Article

Extensive Multiple 2D-/3D-QSAR Modeling, Molecular Docking and Pharmacophoric Approaches for Piperazinylquinoline Derivatives as Respiratory Syncytial Virus Fusion Inhibitors

Journal: Recent Advances in Anti-Infective Drug Discovery
Volume: 18 Issue: 0 Year: 2023 Page: 1-20
Author(s): Vipul P. Purohit,Bapu R. Thorat,Suraj N. Mali,Rahul R. Wagh

Short Communication

Optimization of Pharmacophore of Novel Hybrid Nucleus of 1,3,4-oxadiazole-chalcone Using Literature Findings and In-silico Approach asEGFR Inhibitor

Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 6 Year: 2023 Page: 767-779
Author(s): Shital M. Patil,Shashikant V. Bhandari

Research Article

QSAR Study on the Antitumor Activity of Novel 1,2, 3-Triazole CompoundsBased on Topomer Comfa Method

Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 6 Year: 2023 Page: 674-683
Author(s): Qiu Lie Wei

Research Article

Development of 7H-pyrrolo[2,3-d]pyrimidin-4-amine Derivatives UsingQSARINS Tool as BTK Inhibitors for the Treatment of RheumatoidArthritis

Journal: Anti-Inflammatory & Anti-Allergy Agents in Medicinal Chemistry
Volume: 22 Issue: 4 Year: 2023 Page: 236-249
Author(s):

Research Article

In silico-Based Structural Prediction, Molecular Docking and ADMETAnalysis of Novel Imidazo-Quinoline Derivatives as Pf Purine NucleosidePhosphorylase Inhibitors

Journal: Current Signal Transduction Therapy
Volume: 18 Issue: 1 Year: 2023 Page: 24-53
Author(s): Sushil Kumar Kashaw

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