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Unveiling Bifunctional Hydrogen Bonding with the Help of Quantum Chemistry: The Imidazole-Water Adduct as Test Case

[Image: see text] The ubiquitous role of water and its amphiprotic nature call for a deeper insight into the physical–chemical properties of hydrogen-bonded complexes formed with building blocks of biomolecules. In this work, the semiexperimental (SE) approach combined with the template model (TM) p...

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書目詳細資料
發表在:J Phys Chem A
Main Authors: Melli, Alessio, Barone, Vincenzo, Puzzarini, Cristina
格式: Artigo
語言:Inglês
出版: American Chemical Society 2021
在線閱讀:https://ncbi.nlm.nih.gov/pmc/articles/PMC8154618/
https://ncbi.nlm.nih.gov/pubmed/33818109
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpca.1c01679
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