Department of Biochemistry – Page 8188 – Department of Biochemistry

Journal of Biomolecular Structure and Dynamics

Molecular mechanism of inhibition of COVID-19 main protease by β-adrenoceptor agonists and adenosine deaminase inhibitors using in silico methods

Volume 40, Issue 11, July 2022, Page 5112-5127.

By Pushyaraga P. Venugopal, 4 years ago

Journal of Biomolecular Structure and Dynamics

Computational studies of membrane pore formation induced by Pin2

Volume 40, Issue 11, July 2022, Page 5060-5068.

By José-Luis Velasco-Bolom, 4 years ago

Journal of Biomolecular Structure and Dynamics

Shedding light on the bimolecular interactions of Cafaminol and human serum albumin: spectroscopic characterization and in-silico investigation

Volume 40, Issue 11, July 2022, Page 4893-4904.

By Negar Parvizi, 4 years ago

Journal of Biomolecular Structure and Dynamics

Virtual repurposing of ursodeoxycholate and chenodeoxycholate as lead candidates against SARS-Cov2-Envelope protein: A molecular dynamics investigation

Volume 40, Issue 11, July 2022, Page 5147-5158.

By Reena Yadav, 4 years ago

Journal of Biomolecular Structure and Dynamics

Fisetin 8-C-glucoside as entry inhibitor in SARS CoV-2 infection: molecular modelling study

Volume 40, Issue 11, July 2022, Page 5128-5137.

By Abha Mishra, 4 years ago

Journal of Biomolecular Structure and Dynamics

Revealing the cholinergic inhibition mechanism of Alzheimer’s by galantamine: a metadynamics simulation study

Volume 40, Issue 11, July 2022, Page 5100-5111.

By Shibaji Ghosh, 4 years ago

Journal of Biomolecular Structure and Dynamics

Ensemble-based high-throughput virtual screening of natural ligands using the Super Natural-II database against cell-wall protein dTDP-4-dehydrorhamnose reductase (RmlD) in Mycobacterium tuberculosis

Volume 40, Issue 11, July 2022, Page 5069-5078.

By Rahul Ravichandran, 4 years ago

Journal of Biomolecular Structure and Dynamics

Computational-aided design: minimal peptide sequence to block dengue virus transmission into cells

Volume 40, Issue 11, July 2022, Page 5026-5035.

By Aathe Cangaree Arumugam, 4 years ago

Journal of Biomolecular Structure and Dynamics

Understanding the impact of anticancer halogenated inhibitors and various functional groups (X = Cl, F, CF3, CH3, NH2, OH, H) of casein kinase 2 (CK2)

Volume 40, Issue 11, July 2022, Page 5036-5052.

By Palanisamy Deepa, 4 years ago

Journal of Biomolecular Structure and Dynamics

In silico analysis of phytochemicals as potential inhibitors of proteases involved in SARS-CoV-2 infection

Volume 40, Issue 11, July 2022, Page 5053-5059.

By Palaniyandi Umadevi, 4 years ago