Recent Releases of pylj
pylj - pylj-1.5.2
What's Changed
- added different particle types exclusive interactions to md by @maximillian-dolan in https://github.com/arm61/pylj/pull/68
Full Changelog: https://github.com/arm61/pylj/compare/1.5.1...1.5.2
- Python
Published by arm61 almost 2 years ago
pylj - pylj-1.5.1
What's Changed
- added interactive features to first_principles example notebook by @maximillian-dolan in https://github.com/arm61/pylj/pull/67
Full Changelog: https://github.com/arm61/pylj/compare/1.5.0...1.5.1
- Python
Published by arm61 almost 2 years ago
pylj - pylj-1.5.1
What's Changed
- added interactive features to first_principles example notebook by @maximillian-dolan in https://github.com/arm61/pylj/pull/67
Full Changelog: https://github.com/arm61/pylj/compare/1.5.0...1.5.1
- Python
Published by arm61 almost 2 years ago
pylj - pylj-1.5.0
What's Changed
- Fixing examples Jupyter notebooks and adding Dockerfile by @fab4100 in https://github.com/arm61/pylj/pull/52
- changed jit to njit by @maximillian-dolan in https://github.com/arm61/pylj/pull/59
- adjusted into setup and update scripts so plt widget works by @maximillian-dolan in https://github.com/arm61/pylj/pull/60
- Fixed continuous integration methods by @maximillian-dolan in https://github.com/arm61/pylj/pull/62
- correcting LJ sigma epsilon energy by @maximillian-dolan in https://github.com/arm61/pylj/pull/63
- Changed forcefields to be class based by @maximillian-dolan in https://github.com/arm61/pylj/pull/65
- Create release.yml by @maximillian-dolan in https://github.com/arm61/pylj/pull/66
New Contributors
- @fab4100 made their first contribution in https://github.com/arm61/pylj/pull/52
- @maximillian-dolan made their first contribution in https://github.com/arm61/pylj/pull/59
Full Changelog: https://github.com/arm61/pylj/compare/1.3.4...1.5.0
- Python
Published by arm61 almost 2 years ago
pylj - pylj-1.3.0a
Add new release for zenodo json to work
- Python
Published by arm61 about 7 years ago
pylj - pylj-1.2.1
Now has some numba support to speed up the pure-python implementations
Also the code is black formatted for better readability
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.2.0
Newest version, now with:
- CITATION file
- Buckingham potential
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.1.17
The use of non-Lennard-Jones potential models has now been cleared up, and @symmy596 has added as rather lovely Buckingham potential.
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.1.10
New functionality: - The ability to have a single custom plot alongside the simulation cell visual, more details (https://pylj.readthedocs.io/en/latest/sample.html#pylj.sample.CellPlus)
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.1.8
Fixed a bug in the generation of the time-averaged RDF.
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.1.2
Improved the initial velocity assignment such that it is more meaningful.
- Python
Published by arm61 over 7 years ago
pylj - pylj-1.1.0
There is now support for custom forcefields to be used.
- Python
Published by arm61 almost 8 years ago
pylj - pylj-1.0.2
Repair to the mean squared displacement calculation.
- Python
Published by arm61 almost 8 years ago
pylj - pylj-0.0.20
First verison of pylj to use real units
- Python
Published by arm61 almost 8 years ago
pylj - pylj-v0.0.6a
This is the first acceptable release of pylj
- Python
Published by arm61 about 8 years ago
pylj - pylj-v0.0.4
This is the first alpha release of pylj.
- Python
Published by arm61 about 8 years ago