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Volumn 79, Issue 3, 2007, Pages 854-862

Linking databases of chemical reactions to NMR Data: An exploration of 1H NMR-based reaction classification

Author keywords

[No Author keywords available]

Indexed keywords

CLASSIFICATION (OF INFORMATION); DATABASE SYSTEMS; DEGRADATION; ENZYMES; PHOTOCHEMICAL REACTIONS; SELF ORGANIZING MAPS;

EID: 33846946859     PISSN: 00032700     EISSN: None     Source Type: Journal    
DOI: 10.1021/ac060979s     Document Type: Article
Times cited : (8)

References (49)
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    • 84955734139 scopus 로고    scopus 로고
    • Reaction Classification and Knowledge Acquisition
    • Gasteiger, J, Engel, T, Eds, Wiley-VCH: New York
    • Chen, L. Reaction Classification and Knowledge Acquisition. In Handbook of Chemoinformatics; Gasteiger, J., Engel, T., Eds.; Wiley-VCH: New York, 2003; Vol. 1, pp 348-388.
    • (2003) Handbook of Chemoinformatics , vol.1 , pp. 348-388
    • Chen, L.1
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    • 33846999683 scopus 로고    scopus 로고
    • Sacher, O. Ph.D. Thesis, University of Erlangen-Nuremberg, 2001; http://www2.chemie.uni-erlangen.de/services/dissonline/data/dissertation/ Oliver_Sacher/html/ (accessed Jan 2006).
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.