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Pull requests: mosdef-hub/gmso

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Pull requests list

[pre-commit.ci] pre-commit autoupdate
#823 opened May 27, 2024 by pre-commit-ci bot Loading…
1
Move pandas dataframe handling to external convert_dataframe module
#814 opened Apr 1, 2024 by CalCraven Loading…
9 of 12 tasks
23
Write out rigid water for GROMACS top file
#771 opened Oct 9, 2023 by daico007 Loading…
12
Modified RB and Periodic torsions
#615 opened Dec 15, 2021 by bc118 Loading…
12
Add LayeredDihedral and LayeredImproper support
#569 opened Jul 13, 2021 by umesh-timalsina Loading…
3 of 4 tasks
1
17
Wrap box with molbox's API
#565 opened Jun 29, 2021 by umesh-timalsina Loading…
1
6
Abstract_Site_Representations
#523 opened Mar 11, 2021 by CalCraven Loading…
9 tasks
11
Add virtual templates
#197 opened Jan 24, 2020 by rmatsum836 Loading…
2
ProTip! What’s not been updated in a month: updated:<2024-04-27.