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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...

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Bibliografiske detaljer
Udgivet i:Pharmaceutics
Main Authors: Mazurek, Anna Helena, Szeleszczuk, Łukasz, Pisklak, Dariusz Maciej
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2020
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7284980/
https://ncbi.nlm.nih.gov/pubmed/32369915
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/pharmaceutics12050415
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