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Added oxygen vacancies
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as a subClassOf `chemical substance quality`
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jmillanacosta authored Mar 21, 2024
1 parent 6900c1d commit 6f6a03c
Showing 1 changed file with 14 additions and 6 deletions.
20 changes: 14 additions & 6 deletions internal-dev/cheminf-ext.owl
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<owl:Class rdf:about="http://purl.enanomapper.org/onto/ENM_8000030">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000123"/>
<rdfs:isDefinedBy>Descriptors that have been obtained through modelling.</rdfs:isDefinedBy>
<obo:IAO_0000115>Descriptors that have been obtained through modelling.</obo:IAO_0000115>
<rdfs:label xml:lang="en">predicted descriptors</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.org/onto/ENM_8000031 -->

<owl:Class rdf:about="http://purl.enanomapper.org/onto/ENM_8000031">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000123"/>
<rdfs:isDefinedBy>Descriptors that have been obtained through modelling.</rdfs:isDefinedBy>
<obo:IAO_0000115>Descriptors that have been obtained through modelling.</obo:IAO_0000115>
<rdfs:label xml:lang="en">calculated descriptors</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.org/onto/ENM_8000032 -->

<owl:Class rdf:about="http://purl.enanomapper.org/onto/ENM_8000032">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000123"/>
<rdfs:isDefinedBy>A class of descriptors derived using CDK, the Chemistry Development Kit.</rdfs:isDefinedBy>
<obo:IAO_0000115>A class of descriptors derived using CDK, the Chemistry Development Kit.</obo:IAO_0000115>
<rdfs:label xml:lang="en">cdk descriptors</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.org/onto/ENM_1200002 -->

<owl:Class rdf:about="http://purl.enanomapper.org/onto/ENM_1200002">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000464"/>
<rdfs:isDefinedBy>PMCID is a unique identifier for publications archived in PubMed Central, which may also be indexed in PubMed. </rdfs:isDefinedBy>
<obo:IAO_0000115>PMCID is a unique identifier for publications archived in PubMed Central, which may also be indexed in PubMed. </obo:IAO_0000115>
<rdfs:label xml:lang="en">PubMedCentral Identifier (PMCID)</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.org/onto/ENM_1200003 -->

<owl:Class rdf:about="http://purl.enanomapper.org/onto/ENM_1200003">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000102"/>
<rdfs:isDefinedBy>A crystal structure following the formula ABX3</rdfs:isDefinedBy>
<obo:IAO_0000115>A crystal structure following the formula ABX3</obo:IAO_0000115>
<rdfs:label xml:lang="en">perovskite</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.net/onto/ENM_8461735 -->

<owl:Class rdf:about="http://purl.enanomapper.net/onto/ENM_8461735">
<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/BFO_0000019"/>
<rdfs:isDefinedBy>Increased energy price of a reaction due to steric effects (the atomic spacial arrangement in a molecule or ion)</rdfs:isDefinedBy>
<obo:IAO_0000115>Increased energy price of a reaction due to steric effects (the atomic spacial arrangement in a molecule or ion)</obo:IAO_0000115>
<rdfs:label xml:lang="en">Steric hindrance</rdfs:label>
</owl:Class>

<!-- http://purl.enanomapper.net/onto/ENM_6390284 -->

<owl:Class rdf:about="http://purl.enanomapper.net/onto/ENM_6390284">
<rdfs:subClassOf rdf:resource="http://semanticscience.org/resource/CHEMINF_000101"/>
<obo:IAO_0000115>Point defects in the bulk or surface of a material</obo:IAO_0000115>
<rdfs:label xml:lang="en">Oxygen vacancies</rdfs:label>
</owl:Class>

</rdf:RDF>


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