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Physical Chemistry Chemical Physics : PCCP|November 10, 2025
Why the electron chooses one of two symmetry-related paths in the type II bacterial photosynthetic reaction centersRongmei Judy Wei, Christine Kirmaier, Dewey Holten, et al.The Analyst|December 25, 2014
An azodye-rhodamine-based fluorescent and colorimetric probe specific for the detection of Pd(2+) in aqueous ethanolic solution: synthesis, XRD characterization, computational studies and imaging in live cellsAjit Kumar Mahapatra, Saikat Kumar Manna, Kalipada Maiti, et al.Journal of Biomolecular Structure & Dynamics|July 25, 2020
Molecular docking and dynamics study of natural compound for potential inhibition of main protease of SARS-CoV-2Shafi Mahmud, Mohammad Abu Raihan Uddin, Meemtaheena Zaman, et al.The Journal of Physical Chemistry. B|December 14, 2023
Computing the Relative Affinity of Chlorophylls <i>a</i> and <i>b</i> to Light-Harvesting Complex IIGehan A Ranepura, Junjun Mao, Josh V Vermaas, et al.Briefings in Bioinformatics|January 31, 2021
Virtual screening and molecular dynamics simulation study of plant-derived compounds to identify potential inhibitors of main protease from SARS-CoV-2Shafi Mahmud, Mohammad Abu Raihan Uddin, Gobindo Kumar Paul, et al.Arabian Journal of Chemistry|December 15, 2021
Antiviral peptides against the main protease of SARS-CoV-2: A molecular docking and dynamics studyShafi Mahmud, Suvro Biswas, Gobindo Kumar Paul, et al.Computers in Biology and Medicine|August 17, 2021
Computational screening of 645 antiviral peptides against the receptor-binding domain of the spike protein in SARS-CoV-2Md Minhas Hossain Sakib, Aktiya Anjum Nishat, Mohammad Tarequl Islam, et al.Pageof 3