Computational chemistry

    flowchart
    AA["Associated Authors (27)"]
    C[Computational chemistry]
    BC["Broader Concepts (1)"]
    NC["Narrower Concepts (23)"]
    C== skos:broader ==>BC
    NC== skos:broader ==>C
    AA== dcterms:relation ==>C
    click BC "#broader-concepts"
    click NC "#narrower-concepts"
    click AA "#associated-authors"

    NI["add incoming edge"]
    NO["add outgoing edge"]
    NI-- ? -->C
    C-- ? -->NO
    click NI "#add-incoming-edge"
    click NO "#add-outgoing-edge"
    style NI stroke-width:2px,stroke-dasharray: 5 5
    style NO stroke-width:2px,stroke-dasharray: 5 5

Wikidata

https://www.wikidata.org/wiki/Q369472

OpenAlex ID

https://openalex.org/C147597530 (API record)

OpenAlex Description

branch of chemistry

OpenAlex Level [?]

1

Broader Concepts

• Chemistry

Narrower Concepts

• Accessible surface area
• Annulene
• Cheminformatics
• Crucible (geodemography)
• Density functional theory
• Drug design
• Electronic structure
• Energy minimization
• Gaussian
• HSAB theory
• Hard spheres
• Hartree–Fock method
• Homogentisic acid
• Mathematical chemistry
• Model system
• Molecular dynamics
• Multiscale modeling
• Pericyclic reaction
• Reaction coordinate
• Spectral properties
• Topological index
• Variational method
• octopus (software)

Associated Authors

• Aleksandra Pachalieva
• Anatoly B. Belonoshko
• Andrés Jaramillo-Botero
• Armin Schwartzman
• Brandon Rotavera
• Chenxing Luo
• David A. Barajas-Solano
• Felipe González‐Cataldo
• Fernando Izquierdo-Ruiz
• Filip Simeski
• François Soubiran
• Hilda Sandström
• Ian C. Bourg
• Ivan Černušák
• Jidong Yang
• Jorge Adrián Perera-Burgos
• Mandy Bethkenhagen
• Masashige Shiga
• Maximilian Arthus Schanner
• Michael F. Vansco
• Pedro J. Castro
• R. E. Cohen
• Rebecca L. Caravan
• Swarnendu Sekhar Ghosh
• Sébastien Hamel
• Theodore S. Dibble
• William F. Jenkins

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