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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Bibliographic Details
Main Authors: Shailima Rampogu, Thananjeyan Balasubramaniyam, Joon-Hwa Lee
Format: Article
Language:English
Published: PeerJ Inc. 2023-08-01
Series:PeerJ
Subjects:
Online Access:https://peerj.com/articles/15885.pdf