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nicklynchs chemistry [13 articles]

Neue Publikationen in nicklynchs Bibliothek eingetragen unter dem Bezeichner: chemistry. You can also see everyone's chemistry.
  • Open-access chemistry databases evolving slowly but not surely.
    Nat Rev Drug Discov, Vol. 5, No. 9. (September 2006), pp. 707-708.
    by M Baker
    posted to opensource chemistry by nicklynch on 2008-11-09 14:58:13 as ** along with 1 person hpiwowar
  • A perspective of publicly accessible/open-access chemistry databases.
    Drug discovery today, Vol. 13, No. 11-12. (June 2008), pp. 495-501.
    by AJ Williams
    posted to opensource informatics chemistry by nicklynch on 2008-11-09 14:57:17 as ** along with 1 person dullhunk
  • CO: A chemical ontology for identification of functional groups and semantic comparison of small molecules.
    FEBS Lett, Vol. 579, No. 21. (29 August 2005), pp. 4685-4691.
    by HJ Feldman, M Dumontier, S Ling, N Haider, CW Hogue
    posted to ontology chemistry by nicklynch on 2008-10-28 20:34:55 as ** along with 2 people and 1 group kuhn JeremyZucker MetabolicModeling
  • The influence of drug-like concepts on decision-making in medicinal chemistry
    Nature Reviews Drug Discovery, Vol. 6, No. 11., pp. 881-890.
    by Paul D Leeson, Brian Springthorpe
    posted to chemistry qsar by nicklynch on 2008-06-01 13:52:56 as ** along with 1 person higueruelo
  • Web Service Infrastructure for Chemoinformatics
    Journal of Chemical Information and Modeling, Vol. 47, pp. 1303-1307.
    by Xiao Dong, Kevin E Gilbert, Rajarshi Guha, Randy Heiland, Jungkee Kim, Marlon E Pierce, Geoffrey C Fox, David J Wild
    posted to chemistry webservice by nicklynch on 2008-04-27 18:45:17 as **
  • Flexible Web Service Infrastructure for the Development and Deployment of Predictive Models
    posted to chemistry informatics qsar by nicklynch on 2008-03-16 22:26:15 as **
  • Computer-aided drug discovery and development (CADDD): In silico-chemico-biological approach
    Chemico-Biological Interactions, Vol. 171, No. 2. (30 January 2008), pp. 165-176.
    by IM Kapetanovic
    posted to chemistry compchem by nicklynch on 2008-02-07 22:21:45 as **
  • Can we estimate the accuracy of ADME-Tox predictions?
    Drug Discovery Today, Vol. 11, No. 15-16. (August 2006), pp. 700-707.
    by Igor V Tetko, Pierre Bruneau, Hans-Werner Mewes, Douglas C Rohrer, Gennadiy I Poda
    posted to adme chemistry prediction by nicklynch on 2008-02-07 22:17:12 as **
  • Representation and use of chemistry in the global electronic age
    Org. Biomol. Chem, Vol. 2 (2004), pp. 3192-3203.
    by Peter Murray-Rusta, Henry S Rzepab, Simon, Yong Zhanga
    posted to chemistry informatics semantic web by nicklynch on 2008-02-07 22:14:32 as **
  • Computing chemistry on the web
    Drug Discovery Today, Vol. 10, No. 22. (15 November 2005), pp. 1497-1500.
    by Igor V Tetko
    posted to chemistry informatics web by nicklynch on 2008-02-07 22:01:16 as **
  • Optimizing the use of open-source software applications in drug discovery
    Drug Discovery Today, Vol. 11, No. 3-4. (February 2006), pp. 127-132.
    by Werner J Geldenhuys, Kevin E Gaasch, Mark Watson, David D Allen, Cornelis J Van der Schyf
    posted to chemistry informatics web by nicklynch on 2008-02-07 21:59:53 as ** along with 3 people operon ramensky junehlee
  • Towards a semantic web for chemistry in lifescience
    by Peter Murray-Rust, Henry S Rzepa
    posted to chemistry semantic web by nicklynch on 2006-12-24 19:07:26 as **
  • Bringing Chemical Data onto the Semantic Web
    J. Chem. Inf. Model., Vol. 46, No. 3. (22 May 2006), pp. 939-952.
    by KR Taylor, RJ Gledhill, JW Essex, JG Frey, SW Harris, DC Deroure
    posted to chemistry semantic web by nicklynch on 2006-12-24 18:39:57 as ** along with 2 people alanrw dullhunk
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