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D5.4 - First predictive nanoQSAR models integrated into NanoCommons KnowledgeBase

Sarimveis, Haralambos; Doganis, Philip; Karatzas, Pantelis; Varsou, Dimitra-Danai; Afantitis, Antreas


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<oai_dc:dc xmlns:dc="http://purl.org/dc/elements/1.1/" xmlns:oai_dc="http://www.openarchives.org/OAI/2.0/oai_dc/" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.openarchives.org/OAI/2.0/oai_dc/ http://www.openarchives.org/OAI/2.0/oai_dc.xsd">
  <dc:creator>Sarimveis, Haralambos</dc:creator>
  <dc:creator>Doganis, Philip</dc:creator>
  <dc:creator>Karatzas, Pantelis</dc:creator>
  <dc:creator>Varsou, Dimitra-Danai</dc:creator>
  <dc:creator>Afantitis, Antreas</dc:creator>
  <dc:date>2020-01-09</dc:date>
  <dc:description>This Deliverable report (D5.4) presents the services that have been developed and are available through the NanoCommons infrastructure for generating and validating nano-specific quantitative Structure-Activity Relationships (nanoQSAR) models and applying the models for predicting nanomaterial (NM) end-points for new materials that have not been tested experimentally. We offer two levels of modelling services: (i) Algorithm as a Service (AaaS) which provides the technical tools to model developers for creating nanoQSAR models and deploying them in the NanoCommons Knowledge Base, or (ii) Model as a Service (MaaS) which provides ready-to-use web implementations of nanoQSAR models, that can be used by the community to validate the models or calculate end-point predictions for other NMs as long as these are within the Domain of Applicability (DoA) of the model.</dc:description>
  <dc:identifier>https://zenodo.org/record/3603066</dc:identifier>
  <dc:identifier>10.5281/zenodo.3603066</dc:identifier>
  <dc:identifier>oai:zenodo.org:3603066</dc:identifier>
  <dc:language>eng</dc:language>
  <dc:relation>info:eu-repo/grantAgreement/EC/H2020/731032/</dc:relation>
  <dc:relation>doi:10.5281/zenodo.3603065</dc:relation>
  <dc:relation>url:https://zenodo.org/communities/nanocommons</dc:relation>
  <dc:relation>url:https://zenodo.org/communities/nsc</dc:relation>
  <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
  <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
  <dc:subject>H2020</dc:subject>
  <dc:subject>NanoCommons</dc:subject>
  <dc:subject>Nano QSAR</dc:subject>
  <dc:subject>Knowledge base</dc:subject>
  <dc:title>D5.4 - First predictive nanoQSAR models integrated into NanoCommons KnowledgeBase</dc:title>
  <dc:type>info:eu-repo/semantics/report</dc:type>
  <dc:type>publication-deliverable</dc:type>
</oai_dc:dc>
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