Search Result "re-docking"


Letter Article

Facile Synthesis of 6-Phenyl-6h-chromeno [4, 3-b] Quinoline Derivatives using NaHSO4@SiO2 Re-usable Catalyst and Their Antibacterial Activity Study Correlated by Molecular Docking Studies

Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 7 Year: 2020 Page: 929-938
Author(s): Kancharla Suman,Jyothi Prashanth,Koya Prabhakara Rao,Madala Subramanyam,Vejendla Anuradha,Mandava Venkata Basaveswara Rao

Research Article

In Silico Discovery of Novel Flavonoids as Poly ADP Ribose Polymerase (PARP) Inhibitors

Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 3 Year: 2021 Page: 344-350
Author(s): Ashish Shah,Ghanshyam Parmar,Avinash Kumar Seth

Research Article

The Importance of Structural Water in HDAC8 for Correct Binding Pose Applied forDrug Design of Anticancer Molecules

Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 24 Issue: 15 Year: 2024 Page: 1109-1125
Author(s): Humberto Lubriel Mendoza-Figueroa

eHiTS: An Innovative Approach to the Docking and Scoring Function Problems

Journal: Current Protein & Peptide Science
Volume: 7 Issue: 5 Year: 2006 Page: 421-435
Author(s):

Research Article

Computational Study of Imidazolylporphyrin Derivatives as a Radiopharmaceutical Ligand for Melanoma

Journal: Current Computer-Aided Drug Design
Volume: 14 Issue: 3 Year: 2018 Page: 191-199
Author(s): Fransiska Kurniawan,Rahmana E. Kartasasmita,Naoki Yoshioka,Abdul Mutalib,Daryono H. Tjahjono

Molecular Docking Studies of Novel Arylidene-2, 4-Thiazolidinediones as Potential Aldose Reductase Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 10 Issue: 7 Year: 2013 Page: 604-612
Author(s): Manoj Kumar Gautam,Suresh Thareja

open access plus

New Developments and Applications of Docking and High-Throughput Docking for Drug Design and in silico Screening

Journal: Current Computer-Aided Drug Design
Volume: 2 Issue: 1 Year: 2006 Page: 83-91
Author(s): Philippe Ferrara, John P. Priestle, Eric Vangrevelinghe, Edgar Jacoby

Research Article

Characterization of the Trypanosoma brucei Pteridine Reductase Active- Site using Computational Docking and Virtual Screening Techniques

Journal: Current Computer-Aided Drug Design
Volume: 16 Issue: 5 Year: 2020 Page: 583-598
Author(s): Hina Shamshad,Abdul Hafiz,Ismail I. Althagafi,Maria Saeed,Agha Zeeshan Mirza

Research Article

Design, Microwave Assisted Organic Synthesis and Molecular Docking Studies of Some 4 - (3H)-Quinazolinone Derivatives as Inhibitors of Colchicine- Binding Site of Tubulin

Journal: Current Microwave Chemistry
Volume: 5 Issue: 3 Year: 2018 Page: 198-205
Author(s): Rakesh D. Amrutkar,Mahendra S. Ranawat

Research Article

A Computer - Aided Drug Designing for Pharmacological Inhibition of Mutant ALK for the Treatment of Non-small Cell Lung Cancer

Journal: Current Topics in Medicinal Chemistry
Volume: 19 Issue: 13 Year: 2019 Page: 1129-1144
Author(s): Saphy Sharda,Ravina Khandelwal,Ritu Adhikary,Diksha Sharma,Manisha Majhi,Tajamul Hussain,Anuraj Nayarisseri,Sanjeev Kumar Singh

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