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Steered molecular dynamics simulations for uncovering the molecular mechanisms of drug dissociation and for drug screening: A test on the focal adhesion kinase.
Chung F. Wong
Published in:
J. Comput. Chem. (2018)
Keyphrases
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drug discovery
molecular mechanisms
biological data
molecular dynamics
molecular dynamics simulations
databases
text mining
data collection
statistical analysis
data integration
biological systems
statistical significance