All pull requests

Pull requests

• Automate benchmarks

  #1558·mattwthompson opened Nov 3, 2026Member·4 tasks·

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  8

• Add fix for charge assignment fallback and test

  #1262·j-wags opened Jul 16, 2025Member·3 tasks·

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  2

• Look in $GMXDATA for missing force fields

  #1226·mattwthompson opened May 20, 2025Member·3 tasks·

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  1

• Added simple rounding error solution

  #1167·pbuslaev opened Feb 12, 2025Contributor·3 tasks·

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  1

  14

• [DNM] Try processing more constraints to LAMMPS input files

  #1160·mattwthompson opened Feb 5, 2025Member·3 tasks·

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• Added triclinic boxes for lammps

  #1095·wutobias opened Nov 6, 2024·1 of 3 tasks·

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  9