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Python

PLAMS

Python Library for Automating Molecular Simulations

PythonEmerging

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8

Last push

11mo ago

Recent commits

Latest commits.

Merge pull request #130 from patrickmelix/pEDA
065a666Patrick Melix11mo ago
Merge pull request #293 from SCM-NV/DavidOrmrodMorley/add_hatoms_test_fix
56d7d51dormrod11mo ago
Add guess bonds to add hatoms tests
d41788dDavid Ormrod Morley11mo ago
Last tweaks to band frag docs
32f8600David Ormrod Morley11mo ago
Merge remote-tracking branch 'origin/trunk' into pEDA
5746706David Ormrod Morley11mo ago

Update band frag example and docs

d47441dDavid Ormrod Morley11mo ago

Merge pull request #285 from SCM-NV/DavidOrmrodMorley/packmol-around-remaining-vol-fix

f20f7bbdormrod11mo ago

Update jupyter notebook example for packmol

f23f0a1David Ormrod Morley11mo ago

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