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Two-track virtual screening approach to identify both competitive and allosteric inhibitors of human small C-terminal domain phosphatase 1.
Hwangseo Park
Hye Seon Lee
Bonsu Ku
Sang-Rae Lee
Seung Jun Kim
Published in:
J. Comput. Aided Mol. Des. (2017)
Keyphrases
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virtual screening
chemical structures
data sets
bayesian networks
high throughput
computational models
scoring function
drug discovery