Published August 25, 2022
| Version v1
Dataset
Open
Target-focused library design by pocket-applied computer vision and fragment deep generative linking
Authors/Creators
- 1. University of Strasbourg, Illkirch/FR
- 2. CNRS, University of Strasbourg, Illkirch/FR
Description
Data inputs and outputs used in
Target-focused library design by pocket-applied computer vision and fragment deep generative linking
Code: https://github.com/kimeguida/POEM
Files
Files
(126.9 MB)
| Name | Size | Download all |
|---|---|---|
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md5:5688623fd08789074d697f0f25fdbc73
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25.4 MB | Download |
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md5:cc77dac9d79ffa61cd1cc948f9ddab9a
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101.4 MB | Download |
Additional details
Related works
- Is supplemented by
- Journal article: 10.1021/acs.jmedchem.2c00931 (DOI)