openff-interchange documentation
openff.interchange
interop
internal
lammps

lammps

openff-interchange

openff-interchange documentation

Installation

Installation
Development guidelines
Release History

User's guide

Introduction
Constructing an Interchange
Exporting to other software
Tweaking and Inspecting Parameters
Migrating from other tools

API Reference

openff.interchange

lammps

Interfaces with LAMMPS.

Functions

to_lammps

Write an Interchange object to a LAMMPS data file.

Contents

lammps
- Functions

openff.interchange.interop.internal.gromacs.to_top

openff.interchange.interop.internal.lammps.to_lammps

© Copyright 2020, Open Force Field Initiative. Project structure based on the Computational Molecular Science Python Cookiecutter version 1.2.

Created using Sphinx 4.5.0. and the Open Force Field Sphinx theme

An Open Force Field Initiative project.