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Periodic DFT Calculations—Review of Applications in the Pharmaceutical Sciences
In the introduction to this review the complex chemistry of solid-state pharmaceutical compounds is summarized. It is also explained why the density functional theory (DFT) periodic calculations became recently so popular in studying the solid APIs (active pharmaceutical ingredients). Further, the m...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2020
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7284980/ https://www.ncbi.nlm.nih.gov/pubmed/32369915 http://dx.doi.org/10.3390/pharmaceutics12050415 |