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Discovering new PI3Kα inhibitors with a strategy of combining ligand-based and structure-based virtual screening.
Miao Yu
Qiong Gu
Jun Xu
Published in:
J. Comput. Aided Mol. Des. (2018)
Keyphrases
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virtual screening
drug discovery
chemical structures
high throughput
similarity searching
scoring function
database
end users
early stage
binding sites