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DicePlayer
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refactor/reimplements-charge-opt
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Vitor Hideyoshi
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refactor: restructure dice environment handling and update Python version requirement
2026-03-29 17:57:51 -03:00
.github
/workflows
chore: migrate build system to hatch, switch dependency management to uv, and update CI workflow
2026-02-28 18:58:24 -03:00
diceplayer
refactor: restructure dice environment handling and update Python version requirement
2026-03-29 17:57:51 -03:00
tests
refactor: restructure dice environment handling and update Python version requirement
2026-03-29 17:57:51 -03:00
.gitignore
chore: switches from black and isort to ruff
2026-02-26 17:47:26 -03:00
.pre-commit-config.yaml
chore: switches from black and isort to ruff
2026-02-26 17:47:26 -03:00
.python-version
refactor: update Python version and optimize dice configuration parameters
2026-03-24 23:46:01 -03:00
control.example.yml
refactor: update dice handling and optimization flow to return structured results
2026-03-25 11:05:23 -03:00
phb.ljc.example
Rename phb.ljc.exemple to phb.ljc.example
2022-06-02 13:48:29 -03:00
pyproject.toml
refactor: restructure dice environment handling and update Python version requirement
2026-03-29 17:57:51 -03:00
README.md
Create README.md
2022-08-12 10:50:22 -03:00
uv.lock
refactor: restructure dice environment handling and update Python version requirement
2026-03-29 17:57:51 -03:00
README.md
DicePlayer
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Description
Python Program for Molecular Optimization in Non-Vacuum Mediums
gaussian16
python
Readme
751
KiB
Languages
Python
100%