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Distinction and Quantification of Noncovalent Dispersive and Hydrophobic Effects

The possibilities of comparing computational results of noncovalent interactions with experimental data are discussed, first with respect to intramolecular interactions. For these a variety of experimental data such as heats of formation, crystal sublimation heats, comparison with energy minimized s...

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Bibliografski detalji
Glavni autor: Hans-Jörg Schneider
Format: Artigo
Jezik:Inglês
Izdano: MDPI AG 2024-04-01
Serija:Molecules
Teme:
Online pristup:https://www.mdpi.com/1420-3049/29/7/1591
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