Benchmark Structures and Conformational Landscapes of Amino Acids in the Gas Phase: A Joint Venture of Machine Learning, Quantum Chemistry, and Rotational Spectroscopy-Reference-Cited by-同舟云学术

Benchmark Structures and Conformational Landscapes of Amino Acids in the Gas Phase: A Joint Venture of Machine Learning, Quantum Chemistry, and Rotational Spectroscopy

Published:2023-02-02 Issue:4 Volume:19 Page:1243-1260
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Barone Vincenzo¹^ORCID,Fusè Marco²^ORCID,Lazzari Federico¹^ORCID,Mancini Giordano¹^ORCID

Affiliation:

1. Scuola Normale Superiore di Pisa, piazza dei Cavalieri 7, 56126 Pisa, Italy

2. DMMT-sede Europa, Universitá di Brescia, viale Europa 11, 25121 Brescia, Italy

Funder

Ministero dell'Universit? e della Ricerca

Agenzia Spaziale Italiana

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c01143

Reference121 articles.

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2. Computational molecular spectroscopy

3. Alonso, J. L.; López, J. C. Gas-Phase IR Spectroscopy and Structure of Biological Molecules; Springer: 2015; pp 335–401.

4. A laser-ablation molecular-beam Fourier-transform microwave spectrometer: The rotational spectrum of organic solids

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