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Expose molecule-virtual site map
enhancement
New feature or request
#1076
opened Oct 9, 2024 by
mattwthompson
Support of virtual sites for creating an Interchange New feature or request
openmm
virtual sites
from_openmm
enhancement
#1063
opened Sep 26, 2024 by
hannahbaumann
Allow user-defined New feature or request
lammps
Relating to LAMMPS
thermo_style
options
enhancement
#804
opened Sep 8, 2023 by
mattwthompson
Optimize execution time of common operations with New feature or request
Quantity
s
enhancement
#709
opened May 5, 2023 by
mattwthompson
Support custom non-bonded functional forms without electrostatics handlers
enhancement
New feature or request
#694
opened May 1, 2023 by
mattwthompson
Support custom mixing rules
enhancement
New feature or request
#571
opened Dec 19, 2022 by
mattwthompson
Another thing people use ParmEd for - translate data into a richer format for use in VMD.
enhancement
New feature or request
needs-info
Needs more information from user(s)
#356
opened Dec 13, 2021 by
mrshirts
ProTip!
Follow long discussions with comments:>50.