Results 291 to 300 of about 6,028,998 (307)

Towards understanding the interaction of β-lactoglobulin with capsaicin: Multi-spectroscopic, thermodynamic, molecular docking and molecular dynamics simulation approaches

Food Hydrocolloids, 2020
Bin Li, Yijie Chen, Fuchao Zhan
exaly  

Molecular docking and molecular dynamics simulation approaches for evaluation of laccase-mediated biodegradation of various industrial dyes

Journal of Biomolecular Structure and Dynamics, 2022
Mukesh Samant, Satish Chandra Pandey, Veena Pande   +2 more
exaly  

Identification of natural inhibitors against Mpro of SARS-CoV-2 by molecular docking, molecular dynamics simulation, and MM/PBSA methods

Journal of Biomolecular Structure and Dynamics, 2022
Subhash Chandra, Tushar Joshi, Shalini Mathpal   +2 more
exaly  

Progress in Molecular Docking and Molecular Dynamics Simulation

Journal of Comparative Chemistry, 2019
openaire   +1 more source

Molecular docking and simulation studies on SARS-CoV-2 Mpro reveals Mitoxantrone, Leucovorin, Birinapant, and Dynasore as potent drugs against COVID-19

Journal of Biomolecular Structure and Dynamics, 2021
Kiran Bharat Lokhande, Renu Vyas, K Venkateswara Swamy   +2 more
exaly  

Aphrodisiac Performance of Bioactive Compounds from Mimosa pudica Linn.: In Silico Molecular Docking and Dynamics Simulation Approach

Molecules, 2022
Krishnan Sundar, Parasuraman Pavadai, Piotr Maszczyk   +2 more
exaly  

The potential role of procyanidin as a therapeutic agent against SARS-CoV-2: a text mining, molecular docking and molecular dynamics simulation approach

Journal of Biomolecular Structure and Dynamics, 2022
Nikhil Maroli, Balu Bhasuran, J Natarajan   +2 more
exaly  

Molecular dynamics simulation and molecular docking studies of 1,4-Dihydropyridines as P-glycoprotein’s allosteric inhibitors

Journal of Biomolecular Structure and Dynamics, 2018
Najmeh Edraki, Farshid Zargari, Omolbanin Shahraki   +2 more
exaly  

The Interaction of Polyphenol Flavonoids with β-lactoglobulin: Molecular Docking and Molecular Dynamics Simulation Studies

Journal of Macromolecular Science - Physics, 2012
Mehdi Sahihi
exaly  

An Investigation of Molecular Docking and Molecular Dynamic Simulation on Imidazopyridines as B-Raf Kinase Inhibitors

International Journal of Molecular Sciences, 2015
Xiaoguang Xie
exaly