<?xml version="1.0" encoding="utf-8"?>
<TEI xmlns="http://www.tei-c.org/ns/1.0" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns:hal="http://hal.archives-ouvertes.fr/" xmlns:gml="http://www.opengis.net/gml/3.3/" xmlns:gmlce="http://www.opengis.net/gml/3.3/ce" version="1.1" xsi:schemaLocation="http://www.tei-c.org/ns/1.0 http://api.archives-ouvertes.fr/documents/aofr-sword.xsd">
  <teiHeader>
    <fileDesc>
      <titleStmt>
        <title>HAL TEI export of hal-03133373</title>
      </titleStmt>
      <publicationStmt>
        <distributor>CCSD</distributor>
        <availability status="restricted">
          <licence target="https://creativecommons.org/publicdomain/zero/1.0/">CC0 1.0 - Universal</licence>
        </availability>
        <date when="2026-05-22T14:39:04+02:00"/>
      </publicationStmt>
      <sourceDesc>
        <p part="N">HAL API Platform</p>
      </sourceDesc>
    </fileDesc>
  </teiHeader>
  <text>
    <body>
      <listBibl>
        <biblFull>
          <titleStmt>
            <title xml:lang="en">Trustworthiness, the Key to Grid-Based Map-Driven Predictive Model Enhancement and Applicability Domain Control</title>
            <author role="aut">
              <persName>
                <forename type="first">Dragos</forename>
                <surname>Horvath</surname>
              </persName>
              <email type="md5">4358c9c20dee546e17d652ddaab23e07</email>
              <email type="domain">unistra.fr</email>
              <idno type="idhal" notation="string">dragos-horvath</idno>
              <idno type="idhal" notation="numeric">178284</idno>
              <idno type="halauthorid" notation="string">45017-178284</idno>
              <idno type="RESEARCHERID">http://www.researcherid.com/rid/W-9789-2018</idno>
              <idno type="ORCID">https://orcid.org/0000-0003-0173-5714</idno>
              <idno type="IDREF">https://www.idref.fr/108942368</idno>
              <idno type="RESEARCHERID">http://www.researcherid.com/rid/http://www.researcherid.com/rid/W-9789-2018</idno>
              <affiliation ref="#struct-403339"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Gilles</forename>
                <surname>Marcou</surname>
              </persName>
              <email type="md5">6a46801f3315c4cfd896918cce3cf32f</email>
              <email type="domain">unistra.fr</email>
              <idno type="idhal" notation="string">gilles-marcou</idno>
              <idno type="idhal" notation="numeric">1048023</idno>
              <idno type="halauthorid" notation="string">248716-1048023</idno>
              <idno type="ORCID">https://orcid.org/0000-0003-1676-6708</idno>
              <idno type="IDREF">https://www.idref.fr/076019276</idno>
              <affiliation ref="#struct-403339"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Alexandre</forename>
                <surname>Varnek</surname>
              </persName>
              <email type="md5">63c1f6fb646726b9dbf820624839dd0c</email>
              <email type="domain">chimie.u-strasbg.fr</email>
              <idno type="idhal" notation="numeric">797954</idno>
              <idno type="halauthorid" notation="string">125727-797954</idno>
              <idno type="ORCID">https://orcid.org/0000-0003-1886-925X</idno>
              <idno type="IDREF">https://www.idref.fr/124416993</idno>
              <idno type="GOOGLE SCHOLAR">https://scholar.google.fr/citations?user=hcMM9qYAAAAJ</idno>
              <idno type="VIAF">https://viaf.org/viaf/53685625</idno>
              <idno type="ISNI">http://isni.org/isni/0000000116443453</idno>
              <affiliation ref="#struct-403339"/>
            </author>
            <editor role="depositor">
              <persName>
                <forename>Archive ouverte</forename>
                <surname>univOAK</surname>
              </persName>
              <email type="md5">d35266c520c0e6b54ee7a42aa2ce7360</email>
              <email type="domain">unistra.fr</email>
            </editor>
          </titleStmt>
          <editionStmt>
            <edition n="v1" type="current">
              <date type="whenSubmitted">2021-10-11 11:49:26</date>
              <date type="whenWritten">2020</date>
              <date type="whenModified">2026-04-24 12:02:02</date>
              <date type="whenReleased">2021-10-11 14:02:56</date>
              <date type="whenProduced">2020-12-28</date>
              <date type="whenEndEmbargoed">2021-10-11</date>
              <ref type="file" target="https://hal.science/hal-03133373v1/document">
                <date notBefore="2021-10-11"/>
              </ref>
              <ref type="file" subtype="author" n="1" target="https://hal.science/hal-03133373v1/file/MapPredRevised.pdf" id="file-3373030-2960674">
                <date notBefore="2021-10-11"/>
              </ref>
            </edition>
            <respStmt>
              <resp>contributor</resp>
              <name key="549677">
                <persName>
                  <forename>Archive ouverte</forename>
                  <surname>univOAK</surname>
                </persName>
                <email type="md5">d35266c520c0e6b54ee7a42aa2ce7360</email>
                <email type="domain">unistra.fr</email>
              </name>
            </respStmt>
          </editionStmt>
          <publicationStmt>
            <distributor>CCSD</distributor>
            <idno type="halId">hal-03133373</idno>
            <idno type="halUri">https://hal.science/hal-03133373</idno>
            <idno type="halBibtex">horvath:hal-03133373</idno>
            <idno type="halRefHtml">&lt;i&gt;Journal of Chemical Information and Modeling&lt;/i&gt;, 2020, 60 (12), pp.6020-6032. &lt;a target="_blank" href="https://dx.doi.org/10.1021/acs.jcim.0c00998"&gt;&amp;#x27E8;10.1021/acs.jcim.0c00998&amp;#x27E9;&lt;/a&gt;</idno>
            <idno type="halRef">Journal of Chemical Information and Modeling, 2020, 60 (12), pp.6020-6032. &amp;#x27E8;10.1021/acs.jcim.0c00998&amp;#x27E9;</idno>
            <availability status="restricted">
              <licence target="https://about.hal.science/hal-authorisation-v1/">HAL Authorization<ref corresp="#file-3373030-2960674"/></licence>
            </availability>
          </publicationStmt>
          <seriesStmt>
            <idno type="stamp" n="CNRS">CNRS - Centre national de la recherche scientifique</idno>
            <idno type="stamp" n="UNIV-STRASBG">Université de Strasbourg</idno>
            <idno type="stamp" n="INC-CNRS">Institut de Chimie du CNRS</idno>
            <idno type="stamp" n="SITE-ALSACE">Archive ouverte du site Alsace</idno>
            <idno type="stamp" n="TEST-HALCNRS">Collection test HAL CNRS</idno>
            <idno type="stamp" n="TEST2-HALCNRS">TEST2-HALCNRS</idno>
            <idno type="stamp" n="UNIVOAK">UNIVOAK</idno>
            <idno type="stamp" n="CMC">Chimie de la matière complexe</idno>
          </seriesStmt>
          <notesStmt>
            <note type="audience" n="1">Not set</note>
            <note type="popular" n="0">No</note>
            <note type="peer" n="1">Yes</note>
          </notesStmt>
          <sourceDesc>
            <biblStruct>
              <analytic>
                <title xml:lang="en">Trustworthiness, the Key to Grid-Based Map-Driven Predictive Model Enhancement and Applicability Domain Control</title>
                <author role="aut">
                  <persName>
                    <forename type="first">Dragos</forename>
                    <surname>Horvath</surname>
                  </persName>
                  <email type="md5">4358c9c20dee546e17d652ddaab23e07</email>
                  <email type="domain">unistra.fr</email>
                  <idno type="idhal" notation="string">dragos-horvath</idno>
                  <idno type="idhal" notation="numeric">178284</idno>
                  <idno type="halauthorid" notation="string">45017-178284</idno>
                  <idno type="RESEARCHERID">http://www.researcherid.com/rid/W-9789-2018</idno>
                  <idno type="ORCID">https://orcid.org/0000-0003-0173-5714</idno>
                  <idno type="IDREF">https://www.idref.fr/108942368</idno>
                  <idno type="RESEARCHERID">http://www.researcherid.com/rid/http://www.researcherid.com/rid/W-9789-2018</idno>
                  <affiliation ref="#struct-403339"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Gilles</forename>
                    <surname>Marcou</surname>
                  </persName>
                  <email type="md5">6a46801f3315c4cfd896918cce3cf32f</email>
                  <email type="domain">unistra.fr</email>
                  <idno type="idhal" notation="string">gilles-marcou</idno>
                  <idno type="idhal" notation="numeric">1048023</idno>
                  <idno type="halauthorid" notation="string">248716-1048023</idno>
                  <idno type="ORCID">https://orcid.org/0000-0003-1676-6708</idno>
                  <idno type="IDREF">https://www.idref.fr/076019276</idno>
                  <affiliation ref="#struct-403339"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Alexandre</forename>
                    <surname>Varnek</surname>
                  </persName>
                  <email type="md5">63c1f6fb646726b9dbf820624839dd0c</email>
                  <email type="domain">chimie.u-strasbg.fr</email>
                  <idno type="idhal" notation="numeric">797954</idno>
                  <idno type="halauthorid" notation="string">125727-797954</idno>
                  <idno type="ORCID">https://orcid.org/0000-0003-1886-925X</idno>
                  <idno type="IDREF">https://www.idref.fr/124416993</idno>
                  <idno type="GOOGLE SCHOLAR">https://scholar.google.fr/citations?user=hcMM9qYAAAAJ</idno>
                  <idno type="VIAF">https://viaf.org/viaf/53685625</idno>
                  <idno type="ISNI">http://isni.org/isni/0000000116443453</idno>
                  <affiliation ref="#struct-403339"/>
                </author>
              </analytic>
              <monogr>
                <idno type="halJournalId" status="VALID">21974</idno>
                <idno type="issn">1549-9596</idno>
                <idno type="eissn">1549-960X</idno>
                <title level="j">Journal of Chemical Information and Modeling</title>
                <imprint>
                  <publisher>American Chemical Society</publisher>
                  <biblScope unit="volume">60</biblScope>
                  <biblScope unit="issue">12</biblScope>
                  <biblScope unit="pp">6020-6032</biblScope>
                  <date type="datePub">2020-12-28</date>
                </imprint>
              </monogr>
              <idno type="doi">10.1021/acs.jcim.0c00998</idno>
            </biblStruct>
          </sourceDesc>
          <profileDesc>
            <langUsage>
              <language ident="en">English</language>
            </langUsage>
            <textClass>
              <classCode scheme="halDomain" n="chim.chem">Chemical Sciences/Cheminformatics</classCode>
              <classCode scheme="halTypology" n="ART">Journal articles</classCode>
              <classCode scheme="halOldTypology" n="ART">Journal articles</classCode>
              <classCode scheme="halTreeTypology" n="ART">Journal articles</classCode>
            </textClass>
          </profileDesc>
        </biblFull>
      </listBibl>
    </body>
    <back>
      <listOrg type="structures">
        <org type="laboratory" xml:id="struct-403339" status="VALID">
          <idno type="IdRef">157547027</idno>
          <idno type="ISNI">0000000403671184</idno>
          <idno type="RNSR">200312525F</idno>
          <idno type="ROR">https://ror.org/01cgac405</idno>
          <idno type="Wikidata">Q51781651</idno>
          <orgName>Chimie de la matière complexe</orgName>
          <orgName type="acronym">CMC</orgName>
          <date type="start">2013-01-01</date>
          <desc>
            <address>
              <addrLine>Institut Le Bel - 4, rue Blaise Pascal - 67070 STRASBOURG CEDEX</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://complex-matter.unistra.fr/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-199013" type="direct"/>
            <relation active="#struct-341038" type="direct"/>
            <relation name="UMR7140" active="#struct-441569" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-199013" status="VALID">
          <idno type="IdRef">131056549</idno>
          <idno type="ROR">https://ror.org/00pg6eq24</idno>
          <orgName>Université de Strasbourg</orgName>
          <orgName type="acronym">UNISTRA</orgName>
          <desc>
            <address>
              <addrLine>4 rue Blaise Pascal - CS 90032 - 67081 Strasbourg cedex</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.unistra.fr/</ref>
          </desc>
        </org>
        <org type="institution" xml:id="struct-341038" status="VALID">
          <idno type="IdRef">232435103</idno>
          <idno type="ISNI">000000010626358X</idno>
          <idno type="ROR">https://ror.org/02cte4b68</idno>
          <orgName>Institut de Chimie - CNRS Chimie</orgName>
          <orgName type="acronym">INC-CNRS</orgName>
          <date type="start">2009-10-01</date>
          <desc>
            <address>
              <addrLine>CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE3 rue Michel-Ange75794 PARIS CEDEX 16 - France</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.cnrs.fr/inc</ref>
          </desc>
        </org>
        <org type="regroupinstitution" xml:id="struct-441569" status="VALID">
          <idno type="IdRef">02636817X</idno>
          <idno type="ISNI">0000000122597504</idno>
          <idno type="ROR">https://ror.org/02feahw73</idno>
          <orgName>Centre National de la Recherche Scientifique</orgName>
          <orgName type="acronym">CNRS</orgName>
          <date type="start">1939-10-19</date>
          <desc>
            <address>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.cnrs.fr/</ref>
          </desc>
        </org>
      </listOrg>
    </back>
  </text>
</TEI>