Multi-Objective Drug Design Based on Graph-Fragment Molecular Representation and Deep Evolutionary Learning

Drug discovery is a challenging process with a huge molecular space to be explored and numerous pharmacological properties to be appropriately considered. Among various drug design protocols, fragment-based drug design is an effective way of constraining the search space and better utilizing biologi...

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Main Authors: Muhetaer Mukaidaisi (Author), Andrew Vu (Author), Karl Grantham (Author), Alain Tchagang (Author), Yifeng Li (Author)
Formato: Libro
Publicado: Frontiers Media S.A., 2022-07-01T00:00:00Z.
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