Pacman-charge

Latest version: v1.3.4

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1.3

What's Changed
* Update CM5.png by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/5
* add "keep_connect" by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/6


**Full Changelog**: https://github.com/mtap-research/PACMAN-charge/compare/v1.2.0...v1.3

1.2.0

Update the REPEAT model, the dataset (21,392 CIFs) from ARC-MOF database by diversity selection. Please not that we just used the charges data to train the model, we are not sure the partial charge is correct or not.

What's Changed
* fix cif name with version in the cif name by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/1
* upload figure by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/2
* fix models name and update new repeat by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/3
* update REPEAT charge by sxm13 in https://github.com/mtap-research/PACMAN-charge/pull/4

New Contributors
* sxm13 made their first contribution in https://github.com/mtap-research/PACMAN-charge/pull/1

**Full Changelog**: https://github.com/mtap-research/PACMAN-charge/compare/v1.1...v1.2.0

1.1

this update inludes a model for REPEAT charges.

1.0.0

Initial release includes method outlined in Zhao, Chung, Journal of Chemical Theory and Computation, 2024

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