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Computational Biology and Chemistry|March 11, 2021
Enhancing the binding of the β-sheet breaker peptide LPFFD to the amyloid-β fibrils by aromatic modifications: A molecular dynamics simulation studyPavan Krishna Kanchi, Ashok Kumar DasmahapatraJournal of Molecular Graphics & Modelling|October 4, 2019
Polyproline chains destabilize the Alzheimer's amyloid-β protofibrils: A molecular dynamics simulation studyPavan Krishna Kanchi, Ashok Kumar DasmahapatraJournal of Molecular Graphics & Modelling|March 16, 2021
Destabilization of the Alzheimer's amyloid-β protofibrils by THC: A molecular dynamics simulation studyPavan Krishna Kanchi, Ashok Kumar DasmahapatraJournal of Molecular Modeling|November 19, 2021
Destabilization of the Alzheimer's amyloid-β peptide by a proline-rich β-sheet breaker peptide: a molecular dynamics simulation studyPavan Krishna Kanchi, Ashok Kumar DasmahapatraThe Journal of Physical Chemistry. B|May 24, 2017
Effect of Composition Asymmetry on the Phase Separation and Crystallization in Double Crystalline Binary Polymer Blends: A Dynamic Monte Carlo Simulation StudyAshok Kumar DasmahapatraThe Journal of Chemical Physics|August 3, 2014
Effect of block asymmetry on the crystallization of double crystalline diblock copolymersChitrita Kundu, Ashok Kumar DasmahapatraInternational Journal of Biological Macromolecules|April 19, 2023
Enhanced stability of a disaggregated Aβ fibril on removal of ligand inhibits refibrillation: An all atom Molecular Dynamics simulation studyShivani Gupta, Ashok Kumar DasmahapatraPhysical Chemistry Chemical Physics : PCCP|August 25, 2020
Destabilization potential of phenolics on Aβ fibrils: mechanistic insights from molecular dynamics simulationShivani Gupta, Ashok Kumar DasmahapatraJournal of Biomolecular Structure & Dynamics|December 3, 2021
Destabilization of Aβ fibrils by omega-3 polyunsaturated fatty acids: a molecular dynamics studyShivani Gupta, Ashok Kumar DasmahapatraComputational Biology and Chemistry|June 15, 2023
Lycopene destabilizes preformed Aβ fibrils: Mechanistic insights from all-atom molecular dynamics simulationShivani Gupta, Ashok Kumar DasmahapatraPageof 3