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Computers in Biology and Medicine|July 2, 2021
A distant angiogenin variant causes amyotrophic lateral sclerosis through loss-of-function mechanisms: Insights from long-timescale atomistic simulations and conformational dynamicsAditya K Padhi, Rohit Shukla, Priyam Narain, et al.Iscience|January 25, 2021
High-throughput rational design of the remdesivir binding site in the RdRp of SARS-CoV-2: implications for potential resistanceAditya K Padhi, Rohit Shukla, Prakash Saudagar, et al.Computational Biology and Chemistry|June 16, 2018
Identification of new drug-like compounds from millets as Xanthine oxidoreductase inhibitors for treatment of Hyperuricemia: A molecular docking and simulation studyRajesh Kumar Pathak, Ayushi Gupta, Rohit Shukla, et al.Journal of Biomolecular Structure & Dynamics|January 25, 2019
In silico identification of mimicking molecule(s) triggering von Willebrand factor in human: a molecular drug target for regulating coagulation pathwayGarima Rana, Rajesh Kumar Pathak, Rohit Shukla, et al.The Review of Scientific Instruments|October 27, 2016
Development and characterization of a high yield transportable pulsed neutron source with efficient and compact pulsed power systemRishi Verma, Ekansh Mishra, Prosenjit Dhang, et al.International Journal of Biological Macromolecules|December 19, 2018
Unfolding of Acinetobacter baumannii MurA proceeds through a metastable intermediate: A combined spectroscopic and computational investigationAmit Sonkar, Harish Shukla, Rohit Shukla, et al.Scientific Reports|August 12, 2018
Targeting Nucleotide Binding Domain of Multidrug Resistance-associated Protein-1 (MRP1) for the Reversal of Multi Drug Resistance in CancerDivya Dhasmana, Ashutosh Singh, Rohit Shukla, et al.Journal of Biomolecular Structure & Dynamics|June 14, 2017
Structure-based screening and molecular dynamics simulations offer novel natural compounds as potential inhibitors of Mycobacterium tuberculosis isocitrate lyaseRohit Shukla, Harish Shukla, Amit Sonkar, et al.Canadian Journal of Ophthalmology. Journal Canadien D'Ophtalmologie|September 24, 2023
Improving access to vision rehabilitation care: implementation of the South East Ontario Vision Rehabilitation ServiceKaren Eden, Kathie Doliszny, Rohit Shukla, et al.Frontiers in Molecular Biosciences|February 6, 2023
Disruption of DYRK1A-induced hyperphosphorylation of amyloid-beta and tau protein in Alzheimer's disease: An integrative molecular modeling approachRohit Shukla, Anuj Kumar, David J Kelvin, et al.Pageof 9