interfaces

This is summary documentation for hippynn.interfaces module. Click here for full documentation.

API Summary for sub-modules:

Links to Full Documentation:

hippynn currently has interfaces to the following other codes:

  1. ase for atomic simulation

  2. pyseqm for combined ML-seqm models

  3. schnetpack for usage of schnet models in hippynn.

This subpackage is not available by default; you must import it explicitly.

Modules

ase_interface

For using hippynn with the Atomic Simulation Environment (ASE)

lammps_interface

For using hippynn with LAMMPS.

pyseqm_interface

For using pyseqm with hippynn

schnetpack_interface

Interface to use schnetpack networks with hippynn.