Zobrazeno 1 - 10
of 25
pro vyhledávání: '"Weslley G. D. P. Silva"'
Publikováno v:
Beilstein Journal of Organic Chemistry, Vol 13, Iss 1, Pp 925-937 (2017)
The understanding of the conformational behavior of amino acids and their derivatives is a challenging task. Here, the conformational analysis of esterified and N-acetylated derivatives of L-methionine and L-cysteine using a combination of 1H NMR and
Externí odkaz:
https://doaj.org/article/503308c8573a4ad7a13bf9d1b71a3363
Publikováno v:
Physical Chemistry Chemical Physics. 23:7368-7375
The conformational landscape of the monohydrated complex of N-allylmethylamine (AMA–w) was investigated for the first time using rotational spectroscopy from 8–20 GHz and quantum chemistry calculations. From a total of nine possible energy minima
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::70a92f1128fa86df38f0b9396422656a
https://doi.org/10.1039/d1cp00420d
https://doi.org/10.1039/d1cp00420d
Publikováno v:
ChemPhysChem. 21:2515-2522
The highly variable conformational landscape of N-allylmethylamine (AMA) was investigated using Fourier transform microwave spectroscopy aided by high-level theoretical calculations to understand the energy relationship governing the interconversion
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d0371ea70ccc243bd34b8a5c541b2f84
https://doi.org/10.1002/cphc.202000757
https://doi.org/10.1002/cphc.202000757
Publikováno v:
Physical chemistry chemical physics : PCCP. 24(1)
The conformational landscapes of diallyl ether (DAE) and diallyl sulfide (DAS) were investigated for the first time using rotational spectroscopy from 6-20 GHz supported by quantum mechanical calculations. A significant difference in the conformation
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::550d1a3facb89ead9ca379d46e5a2c37
https://pubmed.ncbi.nlm.nih.gov/34881756
https://pubmed.ncbi.nlm.nih.gov/34881756
Publikováno v:
Journal of Molecular Spectroscopy. 362:1-7
Rotational spectra of 3-mercaptopropionic acid (3-mpa) were measured from 6 to 18 GHz using chirped pulse and cavity-based Fourier transform microwave (FTMW) spectroscopy. Theoretical calculations using the B3LYP-D3BJ and MP2 methods with the aug-cc-
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::82ba9bef19c33afac54c46f3307fceb8
https://doi.org/10.1016/j.jms.2019.05.009
https://doi.org/10.1016/j.jms.2019.05.009
Publikováno v:
New Journal of Chemistry. 43:1757-1763
A comprehensive description on the conformational behaviour of small peptide models is of primary importance to elucidate polypeptide and protein structures and folding pathways. In this paper, an extensive conformational investigation of N-acetyl-N
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::012245b81cff12f30e31f9b2c3816dcb
https://doi.org/10.1039/c8nj05035j
https://doi.org/10.1039/c8nj05035j
Publikováno v:
Proceedings of the 2021 International Symposium on Molecular Spectroscopy.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2142e74a1ef09a036eeec88f4e83046e
https://doi.org/10.15278/isms.2021.wa06
https://doi.org/10.15278/isms.2021.wa06
The rotational fingerprint of the thiophene-water complex was investigated for the first time using Fourier transform microwave spectroscopy (7-20 GHz) aided by quantum mechanical calculations. Transitions for a single species were observed, and the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cb9058af90d22b0f4dd5e1a5bdcc801a
https://hdl.handle.net/1993/36042
https://hdl.handle.net/1993/36042
Publikováno v:
Proceedings of the 2020 International Symposium on Molecular Spectroscopy.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c004d333224b72cfdbc530d8cb571aed
https://doi.org/10.15278/isms.2020.ml09
https://doi.org/10.15278/isms.2020.ml09
Publikováno v:
The journal of physical chemistry. A. 124(19)
The pure rotational spectrum of allyl isothiocyanate (CH2=CHCH2–NCS) was collected from 4 to 26 GHz using Fourier transform microwave (FTMW) spectroscopy. Its analysis revealed the presence of two ...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::215508a8c45b119a5a855ee88b97f696
https://pubmed.ncbi.nlm.nih.gov/32315179
https://pubmed.ncbi.nlm.nih.gov/32315179