Ligand identification in CryoEM and X-ray maps using deep learning
Code and model weights are available on GitHub at https://github.com/jkarolczak/ligands-classification. An accompanying ChimeraX bundle is available at https://github.com/wtaisner/chimerax-ligand-recognizer.
Authors
- John M. Heumann (ORCID: https://orcid.org/0000-0001-6751-3028)
- Michael H. B. Stowell (ORCID: https://orcid.org/0000-0001-7250-1419)
- Dariusz Brzeziński (ORCID: https://orcid.org/0000-0001-9723-525X)
- Michał Nowicki (ORCID: https://orcid.org/0000-0002-2299-9025)
- Jacek Karolczak (ORCID: https://orcid.org/0000-0001-5414-960X)
- Anna Przybyłowska (ORCID: https://orcid.org/0009-0007-1773-996X)
- Konrad Szewczyk (ORCID: https://orcid.org/0000-0002-2432-7978)
- Witold Taisner (ORCID: https://orcid.org/0009-0001-4752-9476)
Institutions
- University of Colorado Boulder (US)
- Poznań University of Technology (PL)
Publication Details
- Journal
- Bioinformatics
- Published
- 2024-12-17
- DOI
- https://doi.org/10.1093/bioinformatics/btae749
- Citations
- 6
- Primary Topic
- Machine Learning in Materials Science
- Type
- article
- Field-Weighted Citation Impact
- 0.70
Funders
- National Institutes of Health
- University of Colorado Boulder