Rahul Jawarkar

9PUBLICATIONS
35CO-AUTHORS
Molecular targetsPhycology (incl. marine grasses)Biomolecular modelling and designCheminformatics and quantitative structure-activity relationshipsCharacterisation of biological macromolecules
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Publications (9)

|Apr 16, 2024
Computational Exploration of Naturally Occurring Flavonoids as TGF-β Inhibitors in Breast Cancer: Insights from Docking and Molecular Dynamics Simulations and In-vitro Cytotoxicity Study.

Umang Shah, Niyati Patel, Mehul Patel

|Mar 13, 2024
Chemical Composition of Piper nigrum L. Cultivar Guajarina Essential Oils and Their Biological Activity.

Bruna de Souza Feitosa, Oberdan Oliveira Ferreira, Celeste de Jesus Pereira Franco

|Jan 16, 2024
RETRACTED: Application of in-silico drug discovery techniques to discover a novel hit for target-specific inhibition of SARS-CoV-2 Mpro's revealed allosteric binding with MAO-B receptor: A theoretical study to find a cure for post-covid neurological disorder.

Magdi E A Zaki, Sami A Al-Hussain, Aamal A Al-Mutairi

|May 02, 2023
In silico study to recognize novel angiotensin-converting-enzyme-I inhibitors by 2D-QSAR and constraint-based molecular simulations.

Sapan Shah, Dinesh Chaple, Vijay H Masand

|Mar 29, 2023
Theoretical and Anti-Klebsiella pneumoniae Evaluations of Substituted 2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide and Imidazopyridine Hydrazide Derivatives.

Suraj N Mali, Amit Anand, Magdi E A Zaki

|Aug 12, 2022
QSAR, Molecular Docking, MD Simulation and MMGBSA Calculations Approaches to Recognize Concealed Pharmacophoric Features Requisite for the Optimization of ALK Tyrosine Kinase Inhibitors as Anticancer Leads.

Rahul D Jawarkar, Praveen Sharma, Neetesh Jain

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Frequent Collaborators

4 joint publications

Abdul Samad

2 joint publications

Nobendu Mukherjee

2 joint publications

Arabinda Ghosh

2 joint publications

Ajaykumar Gandhi