SMILES

https://doi.org/10.1351/goldbook.ST06980
SMILES (Simplified Molecular Input Line Entry System) is a string notation used to describe the nature and topology of molecular structures.
Source:
PAC, 1997, 69, 1137. (Glossary of terms used in computational drug design (IUPAC Recommendations 1997)) on page 1150 [Terms] [Paper]
Citation: 'SMILES' in IUPAC Compendium of Chemical Terminology, 3rd ed. International Union of Pure and Applied Chemistry; 2006. Online version 3.0.1, 2019. https://doi.org/10.1351/goldbook.ST06980 RIS BibTex EndNote
Div. VIIPDFTextJSONHistory
Last revised: February 24, 2014