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SMILES記法
Wikipedia definition
1. Simplified molecular-input line-entry systemThe simplified molecular-input line-entry system or SMILES is a specification in form of a line notation for describing the structure of chemical molecules using short ASCII strings. SMILES strings can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the molecules. The original SMILES specification was developed by Arthur Weininger and David Weininger in the late 1980s.
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