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shirtsgroup / InterMol Public

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Lammps parser fix#379

Open

orionarcher wants to merge 5 commits intoshirtsgroup:mastershirtsgroup/InterMol:masterfrom

orionarcher:lammps_parser_fixorionarcher/InterMol:lammps_parser_fixCopy head branch name to clipboard

Conversation Commits5 (5)Checks Files changed

Open

Lammps parser fix#379
orionarcher wants to merge 5 commits intoshirtsgroup:masterfrom
orionarcher:lammps_parser_fix

Commits

Commits on Oct 15, 2021

change lammps parser to not error if dihedral type is TrigDihedral, i.e. if improper_style is cvff
orionarcher
committed
code copied from PR #349 to add 0s if coefficients in input file are left out
orionarcher
committed
add units to 0 value when filling missing entry
orionarcher
committed
small stylistic changes
orionarcher
committed

Commits on Oct 21, 2021

input files for lammps
orionarcher
committed

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