openff-interchange documentation
openff.interchange
exceptions
openff.interchange.exceptions.GMXMdrunError

openff.interchange.exceptions.GMXMdrunError

openff-interchange

openff-interchange documentation

Installation

Installation
Development guidelines
Release History

User's guide

Introduction
Content of an Interchange object
Exporting to other software
Migrating
Energy Tests

API Reference

openff.interchange

openff.interchange.exceptions.GMXMdrunError

exception openff.interchange.exceptions.GMXMdrunError[source]: Exception for when gmx mdrun fails.

openff.interchange.exceptions.GMXGromppError

openff.interchange.exceptions.GMXRunError

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