Zobrazeno 1 - 10
of 30
pro vyhledávání: '"Nicolás Ramos-Berdullas"'
Publikováno v:
Chemosensors, Vol 11, Iss 5, p 266 (2023)
The ability of 2D hybrid structures formed by boron, nitrogen and carbon atoms (h-BNCs) to act as potential substrates for the surface-enhanced Raman spectroscopy (SERS) detection of dioxin-like pollutants is theoretically analyzed. The strong confin
Externí odkaz:
https://doaj.org/article/601bb01ab9f045dabeda36531fe0e8d6
Publikováno v:
Membranes, Vol 13, Iss 1, p 28 (2022)
The permeation of dioxin-like pollutants, namely, chlorinated dibenzodioxins and dibenzofurans, through lipid membranes has been simulated using classic molecular dynamics (CMD) combined with the umbrella sampling approach. The most toxic forms of ch
Externí odkaz:
https://doaj.org/article/50602404ad6e45348ebd2b2fb5339183
The ability of 2D hybrid structures formed by boron, nitrogen and carbon atoms (h-BNCs) as potential substrates for surface enhanced Raman spectroscopy (SERS) detection of dioxin-like pollutants is theoretically analyzed. The strong confinement and h
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::90e5ead756a8153fda4432e1095e95ff
https://doi.org/10.20944/preprints202304.0044.v1
https://doi.org/10.20944/preprints202304.0044.v1
Publikováno v:
Membranes; Volume 13; Issue 1; Pages: 28
The permeation of dioxin-like pollutants, namely, chlorinated dibenzodioxins and dibenzofurans, through lipid membranes has been simulated using classic molecular dynamics (CMD) combined with the umbrella sampling approach. The most toxic forms of ch
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::26f88863621114cd77b0e25d0deaab10
Autor:
Nicolás Ramos-Berdullas, Pedro A. Sánchez-Murcia, Gustavo Cárdenas, Maximilian F. S. J. Menger
Publikováno v:
Chemistry-A European Journal, 27(15), 4927-4931. Wiley-VCH Verlag GmbH & Co. KGaA
We unveil in this work the main factors that govern the turn-on/off fluorescence of a Se-modified uracil probe at the ribosomal RNA A-site. Whereas the constraint into an “in-plane” conformation of the two rings of the fluorophore is the main dri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ba10ac0c361abe7bd35ba3c03d96bcc0
https://research.rug.nl/en/publications/bc0d9b40-7e67-4b46-9c15-9addfa400491
https://research.rug.nl/en/publications/bc0d9b40-7e67-4b46-9c15-9addfa400491
Publikováno v:
Handbook of Graphene Set
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9c704ed3f02851316ef393979e4f5931
https://doi.org/10.1002/9781119468455.ch100
https://doi.org/10.1002/9781119468455.ch100
Publikováno v:
Physical chemistry chemical physics : PCCP. 23(8)
Some of the most promising materials for application in molecular electronics and spintronics are based on diradical chains. Herein, the proposed relation between increasing conductance with length and diradical character is revisited using ab initio
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::73b61da53107fd453786c0551c96fa38
https://pubmed.ncbi.nlm.nih.gov/33599227
https://pubmed.ncbi.nlm.nih.gov/33599227
Publikováno v:
International Journal of Quantum Chemistry. 121
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fb3b3b2533c5159cdc74aabff4916a1d
https://doi.org/10.1002/qua.26591
https://doi.org/10.1002/qua.26591
Publikováno v:
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. 266:120451
Several experimental and theoretical studies have shown that 2D hybrid structures formed by boron, nitrogen and carbon atoms (h-BNCs) possess a highly tunable linear and non-linear optical responses. Recent advances towards the controlled synthesis o
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::44856158e6891285d5633c72a284350c
https://doi.org/10.1016/j.saa.2021.120451
https://doi.org/10.1016/j.saa.2021.120451
Publikováno v:
Organic Electronics. 61:177-184
An interesting debate has been recently raised around the role played by aromaticity in the electron transport ability of molecular wires. Normally, it is associated to destructive interference effects, so that the more aromatic the wire the less con
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ffe1dfba32edb7b52bb948df5e7d3cc7
https://doi.org/10.1016/j.orgel.2018.05.043
https://doi.org/10.1016/j.orgel.2018.05.043