/tools/Deep-Drug-Coder

Deep-Drug-Coder

pcko1/Deep-Drug-Coder

189 stars55 forksPythonWebsiteAdded February 4, 2026
summary

Deep-Drug-Coder is a generative neural network designed for de novo drug design, utilizing a conditional recurrent neural network to generate SMILES strings based on specified molecular properties. It aims to facilitate the generation of molecules that meet desired bioactivity criteria, making it a valuable tool in the field of drug discovery.

description

A tensorflow.keras generative neural network for de novo drug design, first-authored in Nature Machine Intelligence while working at AstraZeneca.

topics

drug-discoveryneural-networkdenovo-designlstm-neural-networksautoencoderssmiles-stringsmolecules

Ratings

N/A
0 ratings

Rate this tool:

Comments (0)

Sign in to leave a comment.

No comments yet. Be the first to share your thoughts!