kmol
Open operators and kernels for molecular machine learning.
kmol is an independent open-source library for reusable tensor operators,
numerical primitives, and accelerated kernels used by molecular machine-learning
models. It is designed to serve more than one model family and is not the
operator backend of OFoldX.
Scope
- reusable molecular-ML operators and kernels;
- explicit numerical, device, dtype, layout, and autograd contracts;
- portable reference implementations alongside accelerated backends where useful.
Non-goals
- OFoldX-specific operator behavior, which remains in OOps;
- a molecular dataset catalogue or general model zoo;
- silent compatibility fallbacks that change numerical semantics.
Status
This 0.0.0 release reserves the project name and defines the project
direction. The functional API will be introduced in a later release.
License
kmol is licensed under the GNU Affero General Public License, version 3 or
later. See license.md.
1 maintainer
Metadata
1 maintainer
Release files for kmol 0.0.0
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | |
|---|---|---|---|
| kmol-0.0.0.tar.gz | 14.2 kB | Details |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Reset |
|---|---|---|---|---|
| kmol-0.0.0-py3-none-any.whl | Python 3 | none | any | Details |
Total release size: 28.2 kB
Release files / kmol-0.0.0.tar.gz
| Download URL | kmol-0.0.0.tar.gz |
|---|---|
| Size | 14.2 kB |
| Tags | Source |
|
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Release files / kmol-0.0.0-py3-none-any.whl
| Download URL | kmol-0.0.0-py3-none-any.whl |
|---|---|
| Size | 14.0 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
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| Uploaded via |
twine/6.1.0 CPython/3.12.9
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