python314Packages.torchmd-net 3.0.3 single
Library to train state-of-the-art neural networks potentials (NNPs)
- Name
python3.14-torchmd-net-3.0.3- Package set
- python314Packages
- Homepage
- https://github.com/torchmd/torchmd-net
- License
- MIT
- Source
- pkgs/development/python-modules/torchmd-net/default.nix:91
- Derivation
/nix/store/gpjd97853siz4ma0pf4xx9a13q320isy-python3.14-torchmd-net-3.0.3.drv
Maintainers 1
| Handle | Name | Contact | Via |
|---|---|---|---|
| GaetanLepage | Gaetan Lepage | GitHub · gaetan@glepage.com | listed on package |
Dependencies 29
| Package | As | Maintainers | Used by (transitive) | Status |
|---|---|---|---|---|
| python3 3.14.7 | propagatedBuildInputs | 72,537 | team-only | |
| python314Packages.ase 3.29.0 | propagatedBuildInputs | 15 | unmaintained | |
| python314Packages.h5py 3.16.0 | propagatedBuildInputs | 434 | single | |
| python314Packages.lightning 2.6.6 | propagatedBuildInputs | 11 | single | |
| python314Packages.numpy 2.5.2 | propagatedBuildInputs | 11,439 | single | |
| python314Packages.torch 2.13.0 | propagatedBuildInputs | 397 | maintained | |
| python314Packages.torch-geometric 2.8.0.post1 | propagatedBuildInputs | 2 | single | |
| python314Packages.tqdm 4.68.4 | propagatedBuildInputs | 1,068 | single | |
| python314Packages.warp-lang 1.15.0 | propagatedBuildInputs | 3 | single | |
| ensureNewerSourcesForZipFilesHook 26.05pre-git | nativeBuildInputs | 74,596 | unmaintained setup hook | |
| python313Packages.pythonOutputDistHook 26.05pre-git | nativeBuildInputs | 74,564 | unmaintained setup hook | |
| python313Packages.pythonRemoveBinBytecodeHook 26.05pre-git | nativeBuildInputs | 74,584 | unmaintained setup hook | |
| python314Packages.pypaBuildHook 26.05pre-git | nativeBuildInputs | 71,473 | unmaintained setup hook | |
| python314Packages.pypaInstallHook 26.05pre-git | nativeBuildInputs | 71,694 | unmaintained setup hook | |
| python314Packages.pytest-xdist 3.8.0 | nativeBuildInputs | 44,257 | single | |
| python314Packages.pytestCheckHook 26.05pre-git | nativeBuildInputs | 70,075 | unmaintained setup hook | |
| python314Packages.pythonCatchConflictsHook 26.05pre-git | nativeBuildInputs | 71,690 | unmaintained setup hook | |
| python314Packages.pythonImportsCheckHook 26.05pre-git | nativeBuildInputs | 71,715 | unmaintained setup hook | |
| python314Packages.pythonMetadataCheckHook 26.05pre-git | nativeBuildInputs | 71,460 | single setup hook | |
| python314Packages.pythonNamespacesHook 26.05pre-git | nativeBuildInputs | 71,713 | unmaintained setup hook | |
| python314Packages.pythonRelaxDepsHook 26.05pre-git | nativeBuildInputs | 71,476 | unmaintained setup hook | |
| python314Packages.pythonRemoveTestsDirHook 26.05pre-git | nativeBuildInputs | 71,713 | unmaintained setup hook | |
| python314Packages.pythonRuntimeDepsCheckHook 26.05pre-git | nativeBuildInputs | 71,662 | unmaintained setup hook | |
| python314Packages.setuptools 83.0.0 | nativeBuildInputs | 71,381 | team-only | |
| python314Packages.setuptools-scm 10.0.5 | nativeBuildInputs | 70,272 | single | |
| python314Packages.wrapPython 26.05pre-git | nativeBuildInputs | 71,719 | unmaintained setup hook | |
| writableTmpDirAsHomeHook 26.05pre-git | nativeBuildInputs | 66,113 | unmaintained setup hook | |
| bashNonInteractive 5.3p15 | other input | 102,441 | maintained | |
| stdenv 26.05pre-git | other input | 90,330 | team-only |
Used by 0 directly, 0 transitively
No package depends on this one.