Molecular Simulations of Aromatase Reveal New Insights Into the Mechanism of Ligand Binding.

Jiho Park Luke Czapla Rommie E. Amaro

Published in: J. Chem. Inf. Model. (2013)

Keyphrases

drug design
molecular dynamics
drug discovery
data mining
virtual screening
high throughput
information systems
website
selection mechanism
hiv protease
neural network
simulation study
numerical simulations
mechanism design
protein structure prediction