@prefix bioregistry: <https://bioregistry.io/registry/> .
@prefix bioregistry.metaresource: <https://bioregistry.io/metaregistry/> .
@prefix bioregistry.schema: <https://bioregistry.io/schema/#> .
@prefix dcat: <http://www.w3.org/ns/dcat#> .
@prefix dcterms: <http://purl.org/dc/terms/> .
@prefix foaf: <http://xmlns.com/foaf/0.1/> .
@prefix orcid: <https://orcid.org/> .
@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix tib.ts: <https://terminology.tib.eu/ts/ontologies/> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .

bioregistry.metaresource:bioregistry dcterms:hasPart bioregistry:worldavatar.compchem .

bioregistry.metaresource:tib dcterms:hasPart tib.ts:ontocompchem .

bioregistry:worldavatar.compchem a bioregistry.schema:0000001 ;
    rdfs:label "Computational Chemistry Ontology" ;
    dcterms:contributor orcid:0000-0003-4423-4370 ;
    dcterms:description "Linked-data framework for connecting species in chemical kinetic reaction mechanisms with quantum calculations. A mechanism can be constructed from thermodynamic, reaction rate, and transport data that has been obtained either experimentally, computationally, or by a combination of both. In order to implement this approach, two existing ontologies, namely OntoKin, for representing chemical kinetic reaction mechanisms, and OntoCompChem, for representing quantum chemistry calculations, are extended. (from https://nfdi4cat.org/services/ontologie-sammlung/)"^^xsd:string ;
    dcterms:isPartOf bioregistry.metaresource:bioregistry ;
    skos:exactMatch tib.ts:ontocompchem ;
    dcat:keyword "chemical and environmental engineering",
        "chemistry",
        "nfdi4cat",
        "nfdi4chem",
        "ontology" ;
    foaf:homepage <https://como.ceb.cam.ac.uk/preprints/223/> ;
    bioregistry.schema:0000006 "http://theworldavatar.com/ontology/ontocompchem/ontocompchem.owl#$1"^^xsd:string ;
    bioregistry.schema:0000010 <http://www.theworldavatar.com/ontology/ontocompchem/ontocompchem.owl> ;
    bioregistry.schema:0000012 false ;
    bioregistry.schema:0000024 "http://theworldavatar.com/ontology/ontocompchem/ontocompchem.owl#"^^xsd:string ;
    bioregistry.schema:0000029 "worldavatar.compchem" .

orcid:0000-0003-4423-4370 rdfs:label "Charles Tapley Hoyt" ;
    foaf:mbox "cthoyt@gmail.com" .

tib.ts:ontocompchem dcterms:isPartOf bioregistry.metaresource:tib .