RiD-kit
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Use Rid-kit with Local k8s
Prepare files for simulations
Configure simulations
Configure machine resources
Download files from simulation
Configure mcmc dimension reduction
Installation of environment on Slurm
Installation with DeepMD potential support
Trouble Shooting
Rid API
rid package
Subpackages
rid.common package
rid.entrypoint package
rid.flow package
rid.mcmc package
rid.nn package
rid.op package
rid.select package
rid.superop package
rid.task package
rid.tools package
rid.utils package
Submodules
rid.constants module
rid.main module
RiD-kit
Rid API
rid package
rid.common package
rid.common.lammps package
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rid.common.lammps package
Submodules
rid.common.lammps.command module
rid.common.lammps.command.
final_dump
(
dump
:
str
,
selected_idx
,
output_format
:
str
)
[source]
rid.common.lammps.lmp_constant module