Downloads in the 30 and 7 days to October 10, 2026. Refreshed weekly.
Package Information
No reported malware or high/critical advisories · Details
The current version has no OSV.dev malware reports and no critical or high-severity vulnerabilities.
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Dependencies
- ase ==3.26.0
- charset-normalizer ==2.1.0
- dgl ==2.1.0
- gmxtop ==0.0.2
- hydra-core ==1.3.2
- importlib-metadata ==9.0.0
- lightning ==2.3.3
- matplotlib ==3.8.2
- networkx ==3.2.1
- numpy ==1.26.4
- pandas ==2.2.0
- pydantic ==2.7.1
- pytest ==8.3.4
- pyyaml ==6.0.1
- rdkit ==2023.9.1
- scipy ==1.13.0
- seaborn ==0.13.2
- torch ==2.1.0
- torchdata ==0.7.1
- tqdm ==4.66.4
- wandb ==0.28.0