国際化学物質識別子
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^ E.L. Willighagen (2011年9月17日). “ ⇒InChIKey collision: the DIY copy/pastables”. 2012年11月6日閲覧。
^ Akhondi, S. A.; Kors, J. A.; Muresan, S. (2012). ⇒“Consistency of systematic chemical identifiers within and between small-molecule databases”. Journal of Cheminformatics 4 (1): 35. doi:10.1186/1758-2946-4-35. PMC 3539895. PMID 23237381. ⇒http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3539895/?tool=pmcentrez.
外部リンク.mw-parser-output .side-box{margin:4px 0;box-sizing:border-box;border:1px solid #aaa;font-size:88%;line-height:1.25em;background-color:#f9f9f9;display:flow-root}.mw-parser-output .side-box-abovebelow,.mw-parser-output .side-box-text{padding:0.25em 0.9em}.mw-parser-output .side-box-image{padding:2px 0 2px 0.9em;text-align:center}.mw-parser-output .side-box-imageright{padding:2px 0.9em 2px 0;text-align:center}@media(min-width:500px){.mw-parser-output .side-box-flex{display:flex;align-items:center}.mw-parser-output .side-box-text{flex:1}}@media(min-width:720px){.mw-parser-output .side-box{width:238px}.mw-parser-output .side-box-right{clear:right;float:right;margin-left:1em}.mw-parser-output .side-box-left{margin-right:1em}}ウィキデータにはInternational Chemical IdentifiersのプロパティであるP234があります。（使用状況）
ドキュメントとプレゼンテーション
⇒InChI Trust site
⇒IUPAC InChI site
⇒Unofficial InChI FAQ
⇒InChI Technical Manual (PDF, 335 KB)
[1]
⇒Description of the canonicalization algorithm
⇒Googling for InChIs a presentation to the W3C.
The Semantic Chemical Web: GoogleInChI and other Mashups - ウェイバックマシン（2007年2月8日アーカイブ分）, Google Tech Talk by Peter Murray-Rust, 13 Sept 2006
IUPAC InChI - ウェイバックマシン（2007年3月21日アーカイブ分）, Google Tech Talk by Steve Heller and Steve Stein, 2 November 2006
⇒InChI Release 1.02 InChI final version 1.02 and explanation of Standard InChI, January 2009
ソフトウェアとサービス
⇒NCI/CADD Chemical Identifier Resolver Generates and resolves InChI/InChIKeys and many other chemical identifiers
⇒ChemSpider InChI resolver
⇒Search Google for molecules (generates InChI from interactive chemical and searches Google for any pages with embedded InChIs). Requires Javascript enabled on browser
⇒ChemSketch, free chemical structure drawing package that includes input and output in InCHI format
⇒PubChem online molecule editor that supports SMILES/SMARTS and InChI
⇒ChemSpider Services that allows generation of InChI and conversion of InChI to structure (also SMILES and generation of other properties)
MarvinSketch from ChemAxon, implementation to draw structures (or open other file formats) and output to InChI file format
⇒BKchem implements its own InChI parser and uses the IUPAC implementation to generate InChI strings
⇒CompoundSearch implements an InChI and InChI Key search of spectral libraries
⇒JNI-InChI Java library that wraps the InChI library
the Chemistry Development Kit uses JNI-InChI to generate InChIs, can convert InChIs into structures, and generate tautomers based on the InChI algorithms
Bioclipse generates InChI and InChIKeys for drawn structures or opened files
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出典: フリー百科事典『ウィキペディア（Wikipedia）』
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