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Molecular Dynamics Simulation of the Conformational Preferences of Pseudouridine Derivatives: Improving the Distribution in the Glycosidic Torsion Space.
Nivedita Dutta
Joanna Sarzynska
Ansuman Lahiri
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
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molecular dynamics
protein folding
molecular dynamics simulations
scientific data
high performance computing
data distribution
moving objects
optical flow
graphical models
protein structure
amino acids
coarse grained