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How deeply should we analyze non-covalent interactions?
CONTEXT: Just how much effort and detail should we invest in analyzing interactions of the order of 5 kcal mol(−1)? This comment attempts to provide a conciliatory overview of what is often a contentious field and to pose some questions that I hope will eventually lead at least to some consensus. ME...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Springer Berlin Heidelberg
2023
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9911493/ https://www.ncbi.nlm.nih.gov/pubmed/36757533 http://dx.doi.org/10.1007/s00894-023-05460-4 |