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Journal of Physics. Condensed Matter : an Institute of Physics Journal|June 11, 2015
Structure, dynamics, and function of the monooxygenase P450 BM-3: insights from computer simulations studiesDanilo RoccatanoThe Journal of Chemical Physics|April 8, 2024
A molecular dynamics simulation study of glycine/serine octapeptides labeled with 2,3-diazabicyclo[2.2.2]oct-2-ene fluorophoreDanilo RoccatanoThe Journal of Chemical Physics|May 16, 2012
Attraction between like-charged monovalent ionsRonen ZangiPhysical Chemistry Chemical Physics : PCCP|November 15, 2022
Statistical mechanics of dimerizations and its consequences for small systemsRonen ZangiMethods in Molecular Biology (Clifton, N.J.)|March 11, 2020
The Molecular Dynamics Simulation of Peptides on Gold NanosurfacesDanilo RoccatanoCurrent Protein & Peptide Science|August 12, 2008
Computer simulations study of biomolecules in non-aqueous or cosolvent/water mixture solutionsDanilo RoccatanoThe Journal of Physical Chemistry. B|February 27, 2026
Quantitative Integration of FRET and Molecular Dynamics for Modeling Flexible PeptidesDanilo RoccatanoThe Journal of Physical Chemistry. B|July 21, 2006
Characterization of the stereochemical selectivity of beta-hairpin formation by molecular dynamics simulationsPatricia Soto, Ronen ZangiJournal of Chemical Theory and Computation|November 26, 2015
Molecular Dynamics Simulation Study of Chlorophyll a in Different Organic SolventsKhadga Karki, Danilo RoccatanoPageof 12