OpenFF NAGL 0.3.7+9.g10c2555.dirty documentation
openff.nagl
toolkits
openff
validate_smiles

validate_smiles

OpenFF NAGL 0.3.7+9.g10c2555.dirty documentation

Overview
Installation
Theory
Designing a GCN
Training a NAGL model
Examples Using OpenFF NAGL

Developer's Guide

Dev Installation
Toolkit wrappers

CLI Reference

CLI Reference

API Reference

openff.nagl

`validate_smiles`

openff.nagl.toolkits.openff.validate_smiles(smiles: str, toolkit_registry=NAGL_TOOLKIT_REGISTRY)[source]

Contents

validate_smiles
- validate_smiles()

toolkit_registry_function

TYPE_CHECKING

© Copyright 2021+ Open Force Field Initiative.

Created using Sphinx 6.2.1. and the Open Force Field Sphinx theme

An Open Force Field Initiative project.