Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Ben Joseph R. Cuyacot"'
Autor:
Michal Repisky, Kateřina Hönigová, Shib Shankar Paul, Tomáš Vaculovič, Karolina Wawrocka, Ben Joseph R Cuyacot, Radek Marek, Jaromír Marek, Michal Masařík, Jan Chyba, Martin Sojka, Abril C. Castro, Jan Novotný
Publikováno v:
Inorganic Chemistry. 60:17911-17925
This document is the Accepted Manuscript version of a Published Work that appeared in final form in Inorganic Chemistry", copyright © American Chemical Society after peer review and technical editing by the publisher. To access the final edited and
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f501abbc7479f8ccfb65a9f8c5e30dee
https://doi.org/10.1021/acs.inorgchem.1c02467
https://doi.org/10.1021/acs.inorgchem.1c02467
The nature of magnetically induced current densities (MICD) of metallabenzenes and related compounds has been examined with relativistic DFT calculations to assess the magnetic aromaticity of the molecules. The origin of the total MICD has been analy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b8391e62c831da686e2e647f6d54dbdc
https://hdl.handle.net/10037/27972
https://hdl.handle.net/10037/27972
Publikováno v:
Chemistry – A European Journal. 28
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f3fc31ab9f4b52a8fc280e1a23711dd4
https://doi.org/10.1002/chem.202200965
https://doi.org/10.1002/chem.202200965
Publikováno v:
Journal of Chemical Information and Modeling. 61:211-222
The formation of purine and pyrimidine base pairs (BPs), which contributes to shaping of the canonical and noncanonical 3D structures of nucleic acids, is one the most investigated phenomena in chemistry and life sciences. In this contribution, the a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::aff1c75215bca2751b1bd74210dc901d
https://doi.org/10.1021/acs.jcim.0c00642
https://doi.org/10.1021/acs.jcim.0c00642
The term aromaticity in chemistry is reminiscent of symmetric, stable structures that have delocalized electrons and sustain diamagnetic ring currents in the presence of external magnetic fields. The two latter characteristics sometimes mistakenly ar
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6abb503844ac616bff952cc1f60052fd
https://doi.org/10.26434/chemrxiv-2021-3gv6v
https://doi.org/10.26434/chemrxiv-2021-3gv6v