Web service infrastructure for chemoinformatics.
Identifieur interne : 000091 ( PubMed/Checkpoint ); précédent : 000090Web service infrastructure for chemoinformatics.
Auteurs : Xiao Dong [États-Unis] ; Kevin E. Gilbert ; Rajarshi Guha ; Randy Heiland ; Jungkee Kim ; Marlon E. Pierce ; Geoffrey C. Fox ; David J. WildSource :
- Journal of chemical information and modeling [ 1549-9596 ]
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Abstract
The vast increase of pertinent information available to drug discovery scientists means that there is a strong demand for tools and techniques for organizing and intelligently mining this information for manageable human consumption. At Indiana University, we have developed an infrastructure of chemoinformatics Web services that simplifies the access to this information and the computational techniques that can be applied to it. In this paper, we describe this infrastructure, give some examples of its use, and then discuss our plans to use it as a platform for chemoinformatics application development in the future.
DOI: 10.1021/ci6004349
PubMed: 17602467
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Gilbert</name></author><author><name sortKey="Guha, Rajarshi" sort="Guha, Rajarshi" uniqKey="Guha R" first="Rajarshi" last="Guha">Rajarshi Guha</name></author><author><name sortKey="Heiland, Randy" sort="Heiland, Randy" uniqKey="Heiland R" first="Randy" last="Heiland">Randy Heiland</name></author><author><name sortKey="Kim, Jungkee" sort="Kim, Jungkee" uniqKey="Kim J" first="Jungkee" last="Kim">Jungkee Kim</name></author><author><name sortKey="Pierce, Marlon E" sort="Pierce, Marlon E" uniqKey="Pierce M" first="Marlon E" last="Pierce">Marlon E. Pierce</name></author><author><name sortKey="Fox, Geoffrey C" sort="Fox, Geoffrey C" uniqKey="Fox G" first="Geoffrey C" last="Fox">Geoffrey C. Fox</name></author><author><name sortKey="Wild, David J" sort="Wild, David J" uniqKey="Wild D" first="David J" last="Wild">David J. Wild</name></author></titleStmt><publicationStmt><idno type="wicri:source">PubMed</idno><date when="????"><PubDate><MedlineDate>2007 Jul-Aug</MedlineDate></PubDate></date><idno type="doi">10.1021/ci6004349</idno><idno type="RBID">pubmed:17602467</idno><idno type="pmid">17602467</idno><idno type="wicri:Area/PubMed/Corpus">000081</idno><idno type="wicri:Area/PubMed/Curation">000081</idno><idno type="wicri:Area/PubMed/Checkpoint">000081</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en">Web service infrastructure for chemoinformatics.</title><author><name sortKey="Dong, Xiao" sort="Dong, Xiao" uniqKey="Dong X" first="Xiao" last="Dong">Xiao Dong</name><affiliation wicri:level="1"><nlm:affiliation>Indiana University School of Informatics, Community Grids Laboratory, and Chemical Informatics and Cyberinfrastructure Collaboratory, Indiana University, Bloomington, Indiana 47408, USA.</nlm:affiliation><country xml:lang="fr">États-Unis</country><wicri:regionArea>Indiana University School of Informatics, Community Grids Laboratory, and Chemical Informatics and Cyberinfrastructure Collaboratory, Indiana University, Bloomington, Indiana 47408</wicri:regionArea><wicri:noRegion>Indiana 47408</wicri:noRegion></affiliation></author><author><name sortKey="Gilbert, Kevin E" sort="Gilbert, Kevin E" uniqKey="Gilbert K" first="Kevin E" last="Gilbert">Kevin E. Gilbert</name></author><author><name sortKey="Guha, Rajarshi" sort="Guha, Rajarshi" uniqKey="Guha R" first="Rajarshi" last="Guha">Rajarshi Guha</name></author><author><name sortKey="Heiland, Randy" sort="Heiland, Randy" uniqKey="Heiland R" first="Randy" last="Heiland">Randy Heiland</name></author><author><name sortKey="Kim, Jungkee" sort="Kim, Jungkee" uniqKey="Kim J" first="Jungkee" last="Kim">Jungkee Kim</name></author><author><name sortKey="Pierce, Marlon E" sort="Pierce, Marlon E" uniqKey="Pierce M" first="Marlon E" last="Pierce">Marlon E. Pierce</name></author><author><name sortKey="Fox, Geoffrey C" sort="Fox, Geoffrey C" uniqKey="Fox G" first="Geoffrey C" last="Fox">Geoffrey C. Fox</name></author><author><name sortKey="Wild, David J" sort="Wild, David J" uniqKey="Wild D" first="David J" last="Wild">David J. Wild</name></author></analytic><series><title level="j">Journal of chemical information and modeling</title><idno type="ISSN">1549-9596</idno></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass><keywords scheme="KwdEn" xml:lang="en"><term>Database Management Systems</term><term>Informatics</term><term>Internet</term><term>Programming Languages</term></keywords><keywords scheme="MESH" xml:lang="en"><term>Database Management Systems</term><term>Informatics</term><term>Internet</term><term>Programming Languages</term></keywords></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">The vast increase of pertinent information available to drug discovery scientists means that there is a strong demand for tools and techniques for organizing and intelligently mining this information for manageable human consumption. At Indiana University, we have developed an infrastructure of chemoinformatics Web services that simplifies the access to this information and the computational techniques that can be applied to it. In this paper, we describe this infrastructure, give some examples of its use, and then discuss our plans to use it as a platform for chemoinformatics application development in the future.</div></front></TEI><pubmed><MedlineCitation Owner="NLM" Status="MEDLINE"><PMID Version="1">17602467</PMID><DateCreated><Year>2007</Year><Month>07</Month><Day>30</Day></DateCreated><DateCompleted><Year>2007</Year><Month>10</Month><Day>01</Day></DateCompleted><Article PubModel="Print-Electronic"><Journal><ISSN IssnType="Print">1549-9596</ISSN><JournalIssue CitedMedium="Print"><Volume>47</Volume><Issue>4</Issue><PubDate><MedlineDate>2007 Jul-Aug</MedlineDate></PubDate></JournalIssue><Title>Journal of chemical information and modeling</Title><ISOAbbreviation>J Chem Inf Model</ISOAbbreviation></Journal><ArticleTitle>Web service infrastructure for chemoinformatics.</ArticleTitle><Pagination><MedlinePgn>1303-7</MedlinePgn></Pagination><Abstract><AbstractText>The vast increase of pertinent information available to drug discovery scientists means that there is a strong demand for tools and techniques for organizing and intelligently mining this information for manageable human consumption. At Indiana University, we have developed an infrastructure of chemoinformatics Web services that simplifies the access to this information and the computational techniques that can be applied to it. In this paper, we describe this infrastructure, give some examples of its use, and then discuss our plans to use it as a platform for chemoinformatics application development in the future.</AbstractText></Abstract><AuthorList CompleteYN="Y"><Author ValidYN="Y"><LastName>Dong</LastName><ForeName>Xiao</ForeName><Initials>X</Initials><AffiliationInfo><Affiliation>Indiana University School of Informatics, Community Grids Laboratory, and Chemical Informatics and Cyberinfrastructure Collaboratory, Indiana University, Bloomington, Indiana 47408, USA.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Gilbert</LastName><ForeName>Kevin E</ForeName><Initials>KE</Initials></Author><Author ValidYN="Y"><LastName>Guha</LastName><ForeName>Rajarshi</ForeName><Initials>R</Initials></Author><Author ValidYN="Y"><LastName>Heiland</LastName><ForeName>Randy</ForeName><Initials>R</Initials></Author><Author ValidYN="Y"><LastName>Kim</LastName><ForeName>Jungkee</ForeName><Initials>J</Initials></Author><Author ValidYN="Y"><LastName>Pierce</LastName><ForeName>Marlon E</ForeName><Initials>ME</Initials></Author><Author ValidYN="Y"><LastName>Fox</LastName><ForeName>Geoffrey C</ForeName><Initials>GC</Initials></Author><Author ValidYN="Y"><LastName>Wild</LastName><ForeName>David J</ForeName><Initials>DJ</Initials></Author></AuthorList><Language>eng</Language><PublicationTypeList><PublicationType UI="D016428">Journal Article</PublicationType><PublicationType UI="D052061">Research Support, N.I.H., Extramural</PublicationType></PublicationTypeList><ArticleDate DateType="Electronic"><Year>2007</Year><Month>06</Month><Day>29</Day></ArticleDate></Article><MedlineJournalInfo><Country>United States</Country><MedlineTA>J Chem Inf Model</MedlineTA><NlmUniqueID>101230060</NlmUniqueID><ISSNLinking>1549-9596</ISSNLinking></MedlineJournalInfo><CitationSubset>IM</CitationSubset><MeshHeadingList><MeshHeading><DescriptorName MajorTopicYN="N" UI="D003628">Database Management Systems</DescriptorName></MeshHeading><MeshHeading><DescriptorName MajorTopicYN="Y" UI="D048088">Informatics</DescriptorName></MeshHeading><MeshHeading><DescriptorName MajorTopicYN="Y" UI="D020407">Internet</DescriptorName></MeshHeading><MeshHeading><DescriptorName MajorTopicYN="N" UI="D011381">Programming Languages</DescriptorName></MeshHeading></MeshHeadingList></MedlineCitation><PubmedData><History><PubMedPubDate PubStatus="aheadofprint"><Year>2007</Year><Month>6</Month><Day>29</Day></PubMedPubDate><PubMedPubDate PubStatus="pubmed"><Year>2007</Year><Month>7</Month><Day>3</Day><Hour>9</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="medline"><Year>2007</Year><Month>10</Month><Day>2</Day><Hour>9</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="entrez"><Year>2007</Year><Month>7</Month><Day>3</Day><Hour>9</Hour><Minute>0</Minute></PubMedPubDate></History><PublicationStatus>ppublish</PublicationStatus><ArticleIdList><ArticleId IdType="doi">10.1021/ci6004349</ArticleId><ArticleId IdType="pubmed">17602467</ArticleId></ArticleIdList></PubmedData></pubmed><affiliations><list><country><li>États-Unis</li></country></list><tree><noCountry><name sortKey="Fox, Geoffrey C" sort="Fox, Geoffrey C" uniqKey="Fox G" first="Geoffrey C" last="Fox">Geoffrey C. Fox</name><name sortKey="Gilbert, Kevin E" sort="Gilbert, Kevin E" uniqKey="Gilbert K" first="Kevin E" last="Gilbert">Kevin E. Gilbert</name><name sortKey="Guha, Rajarshi" sort="Guha, Rajarshi" uniqKey="Guha R" first="Rajarshi" last="Guha">Rajarshi Guha</name><name sortKey="Heiland, Randy" sort="Heiland, Randy" uniqKey="Heiland R" first="Randy" last="Heiland">Randy Heiland</name><name sortKey="Kim, Jungkee" sort="Kim, Jungkee" uniqKey="Kim J" first="Jungkee" last="Kim">Jungkee Kim</name><name sortKey="Pierce, Marlon E" sort="Pierce, Marlon E" uniqKey="Pierce M" first="Marlon E" last="Pierce">Marlon E. Pierce</name><name sortKey="Wild, David J" sort="Wild, David J" uniqKey="Wild D" first="David J" last="Wild">David J. Wild</name></noCountry><country name="États-Unis"><noRegion><name sortKey="Dong, Xiao" sort="Dong, Xiao" uniqKey="Dong X" first="Xiao" last="Dong">Xiao Dong</name></noRegion></country></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
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