Chemical markup, XML, and the world wide web. 4. CML schema

Journal of Chemical Information and Computer Sciences

Volumn 43, Issue 3, 2003, Pages 757-772

  Murray Rust, Peter ^a   Rzepa, Henry S ^b  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b IMPERIAL COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SOFTWARE; MOLECULAR GRAPHICS; WORLD WIDE WEB; XML;

CHEMICAL MARKUP LANGUAGE (CML);

CHEMICAL ENGINEERING;

EID: 0038512091     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci0256541     Document Type: Article

References (20)

1. Murray-Rust, P.; Leach, C.; Rzepa, H. S. Chemical Markup Language. Abstr. Pap. Am. Chem. Soc. 1995, 210, 40-COMP Part 1.
2. For formal definitions of all terms used in XML, along with specifications and tools, see the main W3C pages at http://www.w3c.org/.
3. Murray-Rust, P.; Rzepa, H. S. J. Chem. Inf. Comput. Sci. 1999, 39, 928. For current specifications and supporting materials, see http://cml.sourceforge.net/ and http://www.xml-cml.org/.
4. Murray-Rust, P.; Rzepa, H. S.; Wright, M.; Zara, S. Chem. Comm. 2000, 1471-1472.
5. Murray-Rust, P.; Rzepa, H. S.; Wright, M. New J. Chem. 2001, 618-634.
6. Murray-Rust, P.; Rzepa, H. S. J. Chem. Inf. Comput. Sci. 2001, 41, 1124.
7. Gkoutos, G. V.; Murray-Rust, P.; Rzepa, H. S.; Viravaidya, C.; Wright, M. Internet J. Chem. 2001, article 12.
8. For reviews, see: Murray-Rust, P.; Rzepa, H. S. Chem. Intl. 2002, 24(4), 9-13. Liao, Y.-M.; Ghandan, Y. H. Anal. Chem. 2002, 74, 389A-390A. Murray-Rust, P.; Rzepa, H. S. Chapter. In Chemoin-formatics - From Data to Knowledge. Part 2. Advanced Topics; Gasteiger, J., Ed.; 2003; in press.
9. For reviews, see: Murray-Rust, P.; Rzepa, H. S. Chem. Intl. 2002, 24(4), 9-13. Liao, Y.-M.; Ghandan, Y. H. Anal. Chem. 2002, 74, 389A-390A. Murray-Rust, P.; Rzepa, H. S. Chapter. In Chemoin-formatics - From Data to Knowledge. Part 2. Advanced Topics; Gasteiger, J., Ed.; 2003; in press.
10. For reviews, see: Murray-Rust, P.; Rzepa, H. S. Chem. Intl. 2002, 24(4), 9-13. Liao, Y.-M.; Ghandan, Y. H. Anal. Chem. 2002, 74, 389A-390A. Murray-Rust, P.; Rzepa, H. S. Chapter. In Chemoin-formatics - From Data to Knowledge. Part 2. Advanced Topics; Gasteiger, J., Ed.; 2003; in press.
11. For the use of Schemas for medical applications, see: Hoelzer, S.; Schweiger, R. K.; Boettcher, H. A.; Tafazzoli, A. G.; Dudeck, J. Med. Informatics Internet Medicine 2001, 26(2), 131-46.
12. Document Schema Definition Languages: http://www.dsdl.org/, Relax-NG: http://www.oasis-open.org/committees/relax-ng/compact-20021121.html, Schematron: http://www.ascc.net/xml/resource/schematron/schematron.html.
13. For a specification and applications, see: http://www.w3.org/TR/SVG/.
14. Anagnostaki, A.; Pavlopoulos, S.; Koutsouris, D. Medinfo 2001, 10, 77-81. See http://www.omg.org/.
15. Stevens, R.; Goble, C.; Horrocks, I.; Bechhofer, S. IEEE Trans. Inf. Technol. Biomedicine 2002, 6(2), 129-34.
16. Murray-Rust, P.; Rzepa, H. S. Data Sci. 2002, 1(1), 84-98; 1(2), 1-65.
17. Murray-Rust, P.; Rzepa, H. S. Data Sci. 2002, 1(1), 84-98; 1(2), 1-65.
18. Ruhl, A. M.; Schafer, R.; Kramer, G. W. JALA 2001, 6(6), 76-82. See, also: http://www.mel.mst.gov/div826/msid/sima/02_instrmnt_chemrefdata.html.
19. Stein, S. E.; Heller, S. A.; Tchekhovskoi, D. V. Abs. Pap. Am. Chem. Soc. 2001, 222, Chicago, IL, United States, August 26-30, CINF-005.
20. Talia, D. IEEE Internet Computing 2002, 6, 67-71. For details of Open Grid Services Archtecture, see: http://www.globus.org/ogsa/.