Exploration of the theobromine–water dimer: comparison with DNA microhydration
Author:
Affiliation:
1. Departamento de Química Física
2. Facultad de Ciencia y Tecnología
3. Universidad del País Vasco (UPV/EHU)
4. Leioa
5. Spain
6. Department of Chemical Sciences
7. Tata Institute of Fundamental Research
8. Mumbai
9. India
Abstract
Exploration of the microhydration of theobromine using laser spectroscopy in jets and DFT calculations shows very similar structures and binding energies to those for microhydration of nucleobases.
Funder
Eusko Jaurlaritza
Ministerio de Ciencia, Innovación y Universidades
Euskal Herriko Unibertsitatea
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP02397C
Reference70 articles.
1. On the Prebiotic Synthesis of Nucleobases, Nucleotides, Oligonucleotides, Pre-RNA and Pre-DNA Molecules
2. C. Menor-Salván , Prebiotic Chemistry and Chemical Evolution of Nucleic Acids , Springer , Cham , 2018
3. Theory, modelling and simulation in origins of life studies
4. Pathways for the formation and evolution of peptides in prebiotic environments
5. Atmospheric composition and climate on the early Earth
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1. A Competition between Relative Stability and Binding Energy in Caffeine Phenyl-Glucose Aggregates: Implications in Biological Mechanisms;International Journal of Molecular Sciences;2023-02-23
2. Aggregation of nucleobases and metabolites: Adenine-theobromine trimers;The Journal of Chemical Physics;2023-02-13
3. Exploring the Influence of Intermolecular Interactions in Prebiotic Chemistry Using Laser Spectroscopy and Calculations;Chemistry – A European Journal;2021-12-02
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