sk Skill · Hello-QM
antechamber
Use AmberTools antechamber for molecular force field parameterization. Generates GAFF/GAFF2 parameters and AM1-BCC or RESP charges for use in AMBER or LAMMPS classical MD simulations.
Open on skills.sh ↗read 2026-09-15
- installs 8w
- 0
- 30-day movement
- starts with the next reading
- Related entries
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- Connections
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bash
- Host repository
- Hello-QM/catgo-LRG
- Compatible with
- Requires AmberTools installed (conda install -c conda-forge ambertools). antechamber, parmchk2, and tleap must be in PATH.
- Host stars
- 199