Property | Value |
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skos:altLabel | - computational
- computational analysis
- chemistry
- computer simulations
- computational methods
- Computational
- computationally
- calculated
- computer models
- calculations
- computations
- computational models
- molecular modeling
- Computational and Theoretical Chemistry
- Computational Chemistry
- Computational Nanotechnology
- Computational chemist
- Computational chemists
- Computational methods
- Computational modelling
- Computational studies
- Computational_chemistry#Software_packages
- Computers in Chemistry
- Quantum chemical calculations
- Quantum mechanical calculations
- Quantum-chemical calculations
- ab initio quantum chemistry programs
- abinitio calculations
- approximate quantum chemical methods
- chemical computing
- computational chemical
- computational chemist
- computational chemistry
- computational chemistry#History
- computational chemists
- computational method
- computational methodology
- computational methods of quantum chemistry
- computational nanotechnology
- computational pathway design
- computational quantum chemistry
- computational studies
- computational theoretical chemistry
- quantum mechanical description
- semiempirical
- sophisticated approximations
- theoretical calculations
- theoretical study
- exploiting quantum chemistry methods in other branches of science
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