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ChemSpaceAL

ChemSpaceAL Python package: an efficient active learning methodology applied to protein-specific molecular generation

Latest release
Feb 24, 2024
Releases
4
Known CVEs
0
First release
Sep 28, 2023
License
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View on Pypi
Repository

Source

batistagroup/chemspaceal
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Security score

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Packages from this repo

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Insights

Activity

Total releases
4
Last 12 months
0
Cadence
~2 months
Dependencies
9

Releases per month

last 12 months

Release mix

  • major 1
  • patch 2
4 releases
Dependencies

Depends on

2.0.1
  • pypi numpy
  • pypi pandas ==1.5.3
  • pypi prolif ==2.0.1
  • pypi pyyaml
  • pypi rdkit
  • pypi scikit-learn
  • pypi torch
  • pypi tqdm
  • pypi wandb

Used by

Nothing tracked depends on this yet.

Releases
Version Released
2.0.1 patch
2.0.0 major
1.0.3 patch
1.0.2 initial