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Selective Inhibition of STAT3 with Respect to STAT1: Insights from Molecular Dynamics and Ensemble Docking Simulations.
Semen O. Yesylevskyy
Christophe Ramseyer
Marc Pudlo
Jean-René Pallandre
Christophe Borg
Published in:
J. Chem. Inf. Model. (2016)
Keyphrases
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molecular dynamics
high performance computing
molecular dynamics simulations
scientific data
protein folding
learning algorithm
fluid flow
digital libraries
data collection
receptive fields