Published November 3, 2019
| Version zenodo
Software
Open
CNN Scoring Function for Flexible Docking
Contributors
Supervisors:
- 1. University of Pittsburgh
- 2. University of Oxford
Description
Development of a deep learning scoring function for docking with flexible side chains, based on the deep learning framework for molecular docking gnina.
Google Summer of Code 2019 project under the OpenChemistry organization.
Files
RMeli/gsoc19-zenodo.zip
Files
(94.0 MB)
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md5:bdb140dc7edf8d1f66b25b59dfa55bac
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Additional details
Related works
- Is supplement to
- https://github.com/RMeli/gsoc19/tree/zenodo (URL)