narupatools

Narupatools is a package containing utilities to make working with Narupa easier.

Modules

app	Application-level code for clients and servers.
ase	Runners and utilities for interfacing between ASE and Narupa.
core	Core code that is useful across narupatools.
frame	Code for handling FrameData and other related objects.
imd	Module for code relating to interactive molecular dynamics.
lammps	Interpolability with the LAMMPS package.
mdanalysis	Code for interface with the MDAnalysis package.
mdtraj	Utilities for interfacing with the MDTraj package.
nglview	Code for interfacing with NGLView.
openmm	Classes and methods for interfacing with the OpenMM package.
physics	Methods relating to calculating physical quantities.
state	Classes and methods for dealing with Narupa shared state in a more intuitive way.