Topology based machine learning models for drug design

Binding affinity prediction from protein-ligand complex is a problem of interest as it is a key step in drug design. A good model for binding affinity prediction can help to lower time needed and cost of drug design. The binding affinity problem is unlike traditional machine learning tasks. Each pro...

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Detalhes bibliográficos
Autor principal: Kang, Hwee Young
Outros Autores: Xia Kelin
Formato: Final Year Project (FYP)
Idioma:English
Publicado em: Nanyang Technological University 2020
Assuntos:
Acesso em linha:https://hdl.handle.net/10356/139100