I have a PhD in Chemistry and I love contributing to open source computational chemistry projects!
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PhD 👨🔬 Cheminformatics, Molecular Modeling & Machine Learning
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Recursion
- Oxford
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23:18
- 1h ahead - cedric.bouysset.net
- https://orcid.org/0000-0002-7814-8158
- @cedricbouysset
- in/cedric-bouysset
Highlights
- Pro
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chemosim-lab/ProLIF
chemosim-lab/ProLIF PublicInteraction Fingerprints for protein-ligand complexes and more
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molhighlighter
molhighlighter PublicMulticolored substructure highlights made easy
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MDAnalysis/mdanalysis
MDAnalysis/mdanalysis PublicMDAnalysis is a Python library to analyze molecular dynamics simulations.
84 contributions in the last year
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Activity overview
Contributed to
chemosim-lab/ProLIF,
cbouy/cbouy.github.io,
MDAnalysis/MDAnalysis.github.io
and 5 other
repositories
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Contribution activity
April 2025
Created 14 commits in 1 repository
Created a pull request in chemosim-lab/ProLIF that received 23 comments
Opened 1 other pull request in 1 repository
chemosim-lab/ProLIF
1
merged
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Type hints bot
This contribution was made on Apr 9
Reviewed 4 pull requests in 2 repositories
MDAnalysis/mdanalysis
2 pull requests
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Update ResidueGroup/SegmentGroup with ids (PDBParser: force chainid to segid / Universe: set groups)
This contribution was made on Apr 7
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changing DL_Poly units
This contribution was made on Apr 2
chemosim-lab/ProLIF
2 pull requests
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Add script to check files for complete type hints (fix #248)
This contribution was made on Apr 6
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Typing annotations for residue.py (Fix #247)
This contribution was made on Apr 3