Published November 14, 2007 | https://doi.org/10.59350/6j774-g9p10

Making the Case: OpenSMILES

Feature image

SMILES is one of the most widely-used line notations in cheminformatics. Yet until very recently, there has been no concerted attempt to develop open SMILES encoding standards.

OpenSMILES aims to change that. By providing a forum in which concerns from the SMILES user community can be voiced, peer-reviewed, and addressed, OpenSMILES introduces a new way for the SMILES language to become better.

A draft OpenSMILES specification is now available for review. For now, the best way to raise issues and otherwise get involved is through the OpenSMILES mailing list.

Additional details

Description

SMILES is one of the most widely-used line notations in cheminformatics. Yet until very recently, there has been no concerted attempt to develop open SMILES encoding standards. OpenSMILES aims to change that. By providing a forum in which concerns from the SMILES user community can be voiced, peer-reviewed, and addressed, OpenSMILES introduces a new way for the SMILES language to become better.

Identifiers

UUID
e9ea5046-eac4-4bb4-9a01-fc97c247307f
GUID
https://depth-first.com/articles/2007/11/14/making-the-case-opensmiles/
URL
https://depth-first.com/articles/2007/11/14/making-the-case-opensmiles

Dates

Issued
2007-11-14T00:00:00
Updated
2007-11-14T00:00:00