| [project] | |
| name = "rocketshp-space" | |
| version = "0.1.0" | |
| description = "Add your description here" | |
| readme = "README.md" | |
| requires-python = ">=3.11" | |
| dependencies = [ | |
| "biopython>=1.79", | |
| "biotite==0.41.2", | |
| "datasets>=4.3.0", | |
| "esm==3.1.3", | |
| "gradio[oauth]>=5.49.1", | |
| "gradio-molecule3d>=0.0.7", | |
| "h5py>=3.15.1", | |
| "huggingface-hub>=0.36.0", | |
| "lightning>=2.4.0", | |
| "loguru>=0.7.3", | |
| "matplotlib>=3.10.7", | |
| "mdanalysis>=2.9.0", | |
| "mdanalysisdata>=0.9.0", | |
| "neptune>=1.13.0", | |
| "nglview>=4.0", | |
| "numpy>=1.23.5", | |
| "numpy-indexed>=0.3.7", | |
| "omegaconf>=2.3.0", | |
| "openpyxl>=3.1.5", | |
| "pandas>=2.3.3", | |
| "python-dateutil>=2.9.0.post0", | |
| "python-dotenv>=1.1.1", | |
| "rocketshp", | |
| "scikit-learn>=1.7.2", | |
| "scipy>=1.16.2", | |
| "seaborn>=0.13.2", | |
| "statsmodels>=0.14.5", | |
| "tokenizers>=0.20.3", | |
| "torchmetrics>=1.8.2", | |
| "tqdm>=4.67.1", | |
| "transformers>=4.46.3", | |
| "typer>=0.20.0", | |
| ] | |
| [tool.uv.sources] | |
| rocketshp = { git = "https://github.com/FlatironInstitute/RocketSHP" } | |