Targeted analytical evaluation of a large small molecule chemical database

Proceedings 50th ASMS Conference on Mass Spectrometry and Allied Topics

Volumn , Issue , 2002, Pages 611-612

  Kelley, James A ^a   Lai, Christopher C ^a   Barchi, Joseph J ^a   Nicklaus, Marc C ^a   Voigt, Johannes H ^a   Anderson, Lynne ^a   Malinowski, Nancy M ^a   Neamati, Nouri ^b  

^a NATIONAL CANCER INSTITUTE   (United States)

^b UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL DATABASES; CLUSTERING ANALYSIS; DRUG DEVELOPMENT; STRUCTURAL INTEGRITY;

CORRELATION METHODS; DATA REDUCTION; DATABASE SYSTEMS; DRUG PRODUCTS; MOLECULAR STRUCTURE; MOLECULAR WEIGHT; NUCLEAR MAGNETIC RESONANCE; ORGANIC COMPOUNDS; STRUCTURE (COMPOSITION);

MASS SPECTROMETRY;

EID: 2442644151     PISSN: None     EISSN: None     Source Type: Conference Proceeding    
DOI: None     Document Type: Conference Paper

References (4)

1. Milne, G.W.A.; Nicklaus, M.C.; Driscoll, J.S.; Wang. S. J. Chem. Inf. Comput. Sci. 1994, 34, 1219-1224.
2. Voigt, J.H.; Bienfait, B.; Wang, S.; Nicklaus, M.C. J. Chem. Inf. Comput. Sci. 2001, 41, 702-712.
3. Ihlenfeldt, W.-D.; Voigt, J.H.; Bienfait, B.; Oellien, F.; Nicklaus, M.C. J. Chem. Inf. Comput. Sci. 2002, 42, 46-57.
4. Chen, I.-J.; Neamati, N.; Nicklaus, M.C.; Orr, A.; Anderson, L.; Barchi, J.J., Jr.; Kelley, J.A.; Pommier, Y.; MacKereil, A.D., Jr. Bioorg. Med. Chem. 2000, 8, 2385-2398.