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Current Status of Quantum Chemical Studies of Cyclodextrin Host–Guest Complexes
This article aims to review the application of various quantum chemical methods (semi-empirical, density functional theory (DFT), second order Møller–Plesset perturbation theory (MP2)) in the studies of cyclodextrin host–guest complexes. The details of applied approaches such as functionals, basis s...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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MDPI
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9229288/ https://www.ncbi.nlm.nih.gov/pubmed/35744998 http://dx.doi.org/10.3390/molecules27123874 |