GMPavanLab / Swarm-CG

Swarm-CG: Automatic Parametrization of Bonded Terms in MARTINI-based Coarse-Grained Models of Simple to Complex Molecules via Fuzzy Self-Tuning Particle Swarm Optimization
https://pubs.acs.org/doi/10.1021/acsomega.0c05469
MIT License
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Add method for checking exec and tests, move eval_function #25

Closed giovannidoni closed 3 years ago

giovannidoni commented 3 years ago

In this pr: I am moving the eval_function, adding tests for the delaying mechanism of exec calls and add a method for testing existence of the executable (+ test that it works)