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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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{
  "inLanguage": {
    "alternateName": "eng", 
    "@type": "Language", 
    "name": "English"
  }, 
  "description": "<p>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.</p>", 
  "license": "https://creativecommons.org/licenses/by/4.0/legalcode", 
  "creator": [
    {
      "affiliation": "National Technical University of Athens", 
      "@id": "https://orcid.org/0000-0002-8607-9965", 
      "@type": "Person", 
      "name": "Sarimveis, Haralambos"
    }, 
    {
      "affiliation": "National Technical University of Athens", 
      "@id": "https://orcid.org/0000-0002-0628-8434", 
      "@type": "Person", 
      "name": "Doganis, Philip"
    }, 
    {
      "affiliation": "National Technical University of Athens", 
      "@type": "Person", 
      "name": "Karatzas, Pantelis"
    }, 
    {
      "affiliation": "NovaMechanics Ltd.", 
      "@id": "https://orcid.org/0000-0002-7474-7014", 
      "@type": "Person", 
      "name": "Varsou, Dimitra-Danai"
    }, 
    {
      "affiliation": "NovaMechanics Ltd.", 
      "@id": "https://orcid.org/0000-0002-0977-8180", 
      "@type": "Person", 
      "name": "Afantitis, Antreas"
    }
  ], 
  "url": "https://zenodo.org/record/3603066", 
  "datePublished": "2020-01-09", 
  "keywords": [
    "H2020", 
    "NanoCommons", 
    "Nano QSAR", 
    "Knowledge base"
  ], 
  "@context": "https://schema.org/", 
  "identifier": "https://doi.org/10.5281/zenodo.3603066", 
  "@id": "https://doi.org/10.5281/zenodo.3603066", 
  "@type": "CreativeWork", 
  "name": "D5.4 - First predictive nanoQSAR models integrated into NanoCommons KnowledgeBase"
}
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