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Curcumin Chalcone Derivatives Database (CCDD): a Python framework for natural compound derivatives database

We built the Curcumin Chalcone Derivatives Database (CCDD) to enable the effective virtual screening of highly potent curcumin and its analogs. The two-dimensional (2D) structures were drawn using the ChemBioOffice package and converted to 3D structures using Discovery Studio Visualizer V 2021 (DS)....

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Detalles Bibliográficos
Autores principales: Rampogu, Shailima, Balasubramaniyam, Thananjeyan, Lee, Joon-Hwa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: PeerJ Inc. 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10440061/
https://www.ncbi.nlm.nih.gov/pubmed/37605747
http://dx.doi.org/10.7717/peerj.15885