Unbinding Pathways of VEGFR2 Inhibitors Revealed by Steered Molecular Dynamics.

Anna Maria Capelli Gabriele Costantino

Published in: J. Chem. Inf. Model. (2014)

Keyphrases

molecular dynamics
drug resistance
high performance computing
scientific data
molecular dynamics simulations
protein folding
computer vision
theoretical analysis
fluid flow
database
state space
fine grained
microarray