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- Simplified_molecular-input_line-entry_system abstract "The 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 initiated by the author David Weininger at the USEPA Mid-Continent Ecology Division Laboratory in Duluth in the 1980s. Acknowledged for their parts in the early development were "Gilman Veith and Rose Russo (USEPA) and Albert Leo and Corwin Hansch (Pomona College) for supporting the work, and Arthur Weininger (Pomona; Daylight CIS) and Jeremy Scofield (Cedar River Software, Renton, WA) for assistance in programming the system." The Environmental Protection Agency funded the initial project to develop SMILES.It has since been modified and extended by others, most notably by Daylight Chemical Information Systems. In 2007, an open standard called "OpenSMILES" was developed by the Blue Obelisk open-source chemistry community. Other 'linear' notations include the Wiswesser Line Notation (WLN), ROSDAL and SLN (Tripos Inc).In July 2006, the IUPAC introduced the InChI as a standard for formula representation. SMILES is generally considered to have the advantage of being slightly more human-readable than InChI; it also has a wide base of software support with extensive theoretical (e.g., graph theory) backing.".
- Simplified_molecular-input_line-entry_system thumbnail SMILES.png?width=300.
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- Simplified_molecular-input_line-entry_system wikiPageExternalLink www.jsdraw.com.
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- Simplified_molecular-input_line-entry_system wikiPageExternalLink www.opensmiles.org.
- Simplified_molecular-input_line-entry_system wikiPageID "28569".
- Simplified_molecular-input_line-entry_system wikiPageRevisionID "605784249".
- Simplified_molecular-input_line-entry_system extension ".smi".
- Simplified_molecular-input_line-entry_system genre Chemical_file_format.
- Simplified_molecular-input_line-entry_system hasPhotoCollection Simplified_molecular-input_line-entry_system.
- Simplified_molecular-input_line-entry_system mime "chemical/x-daylight-smiles".
- Simplified_molecular-input_line-entry_system name "SMILES".
- Simplified_molecular-input_line-entry_system subject Category:Chemical_file_formats.
- Simplified_molecular-input_line-entry_system subject Category:Chemical_nomenclature.
- Simplified_molecular-input_line-entry_system subject Category:Cheminformatics.
- Simplified_molecular-input_line-entry_system subject Category:Encodings.
- Simplified_molecular-input_line-entry_system type Abstraction100002137.
- Simplified_molecular-input_line-entry_system type Act100030358.
- Simplified_molecular-input_line-entry_system type Activity100407535.
- Simplified_molecular-input_line-entry_system type ChemicalFileFormats.
- Simplified_molecular-input_line-entry_system type Communication100033020.
- Simplified_molecular-input_line-entry_system type Cryptography100614489.
- Simplified_molecular-input_line-entry_system type Encoding100615887.
- Simplified_molecular-input_line-entry_system type Encodings.
- Simplified_molecular-input_line-entry_system type Event100029378.
- Simplified_molecular-input_line-entry_system type Format106636806.
- Simplified_molecular-input_line-entry_system type Information106634376.
- Simplified_molecular-input_line-entry_system type Message106598915.
- Simplified_molecular-input_line-entry_system type PsychologicalFeature100023100.
- Simplified_molecular-input_line-entry_system type Writing100614224.
- Simplified_molecular-input_line-entry_system type YagoPermanentlyLocatedEntity.
- Simplified_molecular-input_line-entry_system comment "The 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 initiated by the author David Weininger at the USEPA Mid-Continent Ecology Division Laboratory in Duluth in the 1980s.".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES".
- Simplified_molecular-input_line-entry_system label "SMILES記法".
- Simplified_molecular-input_line-entry_system label "Simplified Molecular Input Line Entry Specification".
- Simplified_molecular-input_line-entry_system label "Simplified Molecular Input Line Entry Specification".
- Simplified_molecular-input_line-entry_system label "Simplified molecular-input line-entry system".
- Simplified_molecular-input_line-entry_system label "مواصفات الإدخال النصي المبسط للجزيئات".
- Simplified_molecular-input_line-entry_system label "简化分子线性输入规范".
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs Simplified_Molecular_Input_Line_Entry_Specification.
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs Simplified_Molecular_Input_Line_Entry_Specification.
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs SMILES記法.
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs SMILES.
- Simplified_molecular-input_line-entry_system sameAs m.0729b.
- Simplified_molecular-input_line-entry_system sameAs Q466769.
- Simplified_molecular-input_line-entry_system sameAs Q466769.
- Simplified_molecular-input_line-entry_system sameAs Simplified_molecular-input_line-entry_system.
- Simplified_molecular-input_line-entry_system wasDerivedFrom Simplified_molecular-input_line-entry_system?oldid=605784249.
- Simplified_molecular-input_line-entry_system depiction SMILES.png.
- Simplified_molecular-input_line-entry_system isPrimaryTopicOf Simplified_molecular-input_line-entry_system.
