computational chemistry

Preferred Label : computational chemistry;

IUPAC definition : Computational chemistry is a discipline using mathematical methods for the calculation of molecular properties or for the simulation of molecular behaviour. It also includes, i e.g /i ., synthesis planning, database searching, combinatorial library manipulation.;

Détails

Origin ID

CT06952;

UMLS CUI

C0872134;

Currated CISMeF NLP mapping
- Cheminformatics [MeSH concept]
- Cheminformatics [MeSH Descriptor]
- Cheminformatics [EDAM topic]
- Chemoinformatics [EFMI term]
- Computational Chemistry [MeSH Descriptor]
- Computational Chemistry [NCIt concept]
- Computational chemistry [EDAM topic]
See also
- computer-assisted molecular modeling [IUPAC Term]
- molecular modeling [IUPAC Term]
Semantic type(s)
- Biomedical Occupation or Discipline [UMLS semantic type]
- Spatial Concept [UMLS semantic type]
UMLS correspondences (same concept)
- Computational Chemistry [NCIt concept]
- Computational Chemistry [MeSH Descriptor]

Position du mot-clé dans l'(les) arborescence(s) :

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