gufe
gufe is a toolkit for developers of software related to alchemical free energy calculations, containing data models and abstract base classes.
Looking to run a free energy calculation? You're probably looking for openfe
License
This library is made available under the MIT open source license.
API stability
Our 1.0 releases follow semantic versioning and we will make an effort to keep the 1.0 API stable.
Installation
To install, run
conda install -c conda-forge gufe
Authors
The Open Free Energy development team.
Acknowledgements
Open Free Energy is an Open Molecular Software Foundation hosted project.
1 maintainer
Metadata
1 maintainer
Release files for acellera-gufe 1.13.1
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| acellera_gufe-1.13.1.tar.gz | 2.2 MB | Without provenance | Details for acellera_gufe-1.13.1.tar.gz |
Release files / acellera_gufe-1.13.1.tar.gz
| Download URL | acellera_gufe-1.13.1.tar.gz |
|---|---|
| Size | 2.2 MB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
3c3f146e094b366a624d63be921ba149713f151e9f82961a7e6d67377ab98e39
|
|
BLAKE2b-256 checksum How to use checksums |
e5beb950a8e6a501204960a64badab5d453841cf5c89a57d39483bcf07a88cb5
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/6.2.0 CPython/3.11.13
|
Security for acellera-gufe 1.13.1
Provenance
Provenance describes where a file came from. On PyPI, provenance is shared via attestations, which provide a verifiable record of the build or publishing details. View details, limitations and caveats.
No provenance found
None of the files in this release were uploaded with provenance metadata.
A note on package security
PyPI is a repository for distributing packages, not a service for auditing them. While third-party security researchers and our staff do their best to detect and remove malicious packages, PyPI cannot guarantee the quality, security or suitability of any given package.
To learn more about protecting yourself from malicious actors, visit our package security documentation.
