The peleffy (PELE Force Field Yielder) is a Python package that builds PELE-compatible force field templates.
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Nov 23, 2024 - Python
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pele
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Aug 30, 2019 - Python
A compilation of benchmarks to validate the parameterization of peleffy (PELE Force Field Yielder).
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Dec 17, 2020 - Jupyter Notebook
Python program to run several PELE simulations in a very authomaticall way
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Mar 28, 2020 - Python
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