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[pre-commit.ci] auto fixes from pre-commit.com hooks
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pre-commit-ci[bot] committed Aug 25, 2024
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2 changes: 1 addition & 1 deletion README.md
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Expand Up @@ -91,7 +91,7 @@ $$+ K_3 * (1 + cos(n_3*\theta - d_3)) + K_4 * (1 + cos(n_4*\theta) - d_4)$$

$$where: n_0 = 0 ; n_1 = 1 ; n_2 = 2 ; n_3 = 3 ; n_4 = 4 $$

$$d_0 = 90^o ; d_1 = 180^o ; d_2 = 0^o ; d_3 = 180^o ; d_4 = 0^o
$$d_0 = 90^o ; d_1 = 180^o ; d_2 = 0^o ; d_3 = 180^o ; d_4 = 0^o
## Examples
Some basic workflows that use this package and cover several force field (FF) types are [here](https://github.com/GOMC-WSU/GOMC_Examples/tree/main/MoSDeF-dihedral-fit). A summary of the FFs covered in the examples are listed below.
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2 changes: 1 addition & 1 deletion paper/paper.bib
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Expand Up @@ -670,4 +670,4 @@ @Inbook{Frekel:2002
title={Understanding Molecular Simulation From Algorithms to Applications (2nd ed.)},
year={2002},
publisher={Academic Press},
}
}

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