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We need better tutorials to help people building a force field from scratch. I'm imagining the following progression:
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Force field for a simple system of
A
particles. The only interactions are nonbonded, 12-6 LJ. -
Now the system of
A
particles featuresA-A
dimers. The force field needs a harmonic bond potential added. -
Same idea as 2, except with trimers and tetramers, thus needing angles and proper dihedrals.
It might also be nice to find a paper with some force field parameters and have a tutorial that includes a snapshot of the table from the paper (maybe some images of the relevant molecules too) and walks through how to take this information and put it into a Foyer force field XML.
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