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Journal of Molecular Modeling|May 31, 2008
An insilico approach to high altitude pulmonary edema - Molecular modeling of human beta2 adrenergic receptor and its interaction with Salmeterol & NifedipineGayathri Devi Chandramoorthi, Shanmughavel Piramanayagam, Parthiban Marimuthu
Biomolecules|August 1, 2020
Predicted Hotspot Residues Involved in Allosteric Signal Transmission in Pro-Apoptotic Peptide-Mcl1 ComplexesParthiban Marimuthu, Jamoliddin Razzokov, Kalaimathy Singaravelu, et al.
Journal of Chemical Information and Modeling|November 18, 2022
Multispectroscopic and Computational Investigations on the Binding Mechanism of Dicaffeoylquinic Acids with OvalbuminPerumal Manivel, Parthiban Marimuthu, Sun Yu, et al.
Journal of Biomolecular Structure & Dynamics|January 12, 2018
In silico approaches to evaluate the molecular properties of organophosphate compounds to inhibit acetylcholinesterase activity in houseflyParthiban Marimuthu, Yong-Jin Lee, ByungHoon Kim, et al.
International Journal of Molecular Sciences|April 13, 2023
Effect of Electric Field on α-Synuclein Fibrils: Revealed by Molecular Dynamics SimulationsJamoliddin Razzokov, Sunnatullo Fazliev, Mukhriddin Makhkamov, et al.
Journal of Chemical Information and Modeling|July 9, 2021
Mapping the Molecular Architecture Required for Lipid-Binding Pockets Using a Subset of Established and Orphan G-Protein Coupled ReceptorsShanthi Nagarajan, Zu Yuan Qian, Parthiban Marimuthu, et al.
Scientific Reports|January 1, 2020
Synthesis and Evaluation of Anisomelic acid-like Compounds for the Treatment of HPV-Mediated CarcinomasRajendran Senthilkumar, Yury Brusentsev, Preethy Paul, et al.
Journal of Chemical Information and Modeling|December 28, 2016
Plasma Protein Binding of Anisomelic Acid: Spectroscopy and Molecular Dynamic SimulationsRajendran Senthilkumar, Parthiban Marimuthu, Preethy Paul, et al.
Current Molecular Pharmacology|April 21, 2021
Wnt/β-catenin Antagonists: Exploring New Avenues to Trigger Old Drugs in Alleviating Glioblastoma MultiformeDaisy S Precilla, Shreyas S Kuduvalli, Mugilarasi Purushothaman, et al.
Biomedicine & Pharmacotherapy = Biomedecine & Pharmacotherapie|January 30, 2023
Bias-force guided simulations combined with experimental validations towards GPR17 modulators identificationSana Kari, Akshaya Murugesan, Ramesh Thiyagarajan, et al.
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