Zobrazeno 1 - 10
of 238
pro vyhledávání: '"Massimiliano Aschi"'
Autor:
Antonio Arcadi, Massimiliano Aschi, Marco Chiarini, Giancarlo Fabrizi, Andrea Fochetti, Antonella Goggiamani, Federica Iavarone, Antonia Iazzetti, Andrea Serraiocco, Roberta Zoppoli
Publikováno v:
ACS Omega, Vol 9, Iss 26, Pp 28450-28462 (2024)
Externí odkaz:
https://doaj.org/article/e7d9843753564ca1968a928ada9dc238
Autor:
Valerio Morlacci, Massimiliano Aschi, Marco Chiarini, Caterina Momoli, Laura Palombi, Antonio Arcadi
Publikováno v:
Molecules, Vol 29, Iss 15, p 3693 (2024)
Brønsted acid-catalysed/mediated reactions of the 2-alkynylanilines are reported. While metal-catalysed reactions of these valuable building blocks have led to the establishment of robust protocols for the selective, diverse-oriented syntheses of si
Externí odkaz:
https://doaj.org/article/254aeca0082246a5be5581dc523e84df
Autor:
Valerio Morlacci, Massimiliano Aschi, Marco Chiarini, Antonio Massa, Antonio Arcadi, Laura Palombi
Publikováno v:
Molbank, Vol 2023, Iss 2, p M1628 (2023)
The title compound has been synthetized using a one-pot cascade process of ethyl (E)-3-(2-aminophenyl) acrylate and 2-formylbenzonitrile in the presence of Cs2CO3 as the catalyst. The synthetic route has been rationalized as a base-catalyzed tandem a
Externí odkaz:
https://doaj.org/article/32127e1682a14cb0ad0f2ad3a5b3df26
Publikováno v:
Molecules, Vol 28, Iss 8, p 3591 (2023)
The electronic circular dichroism (ECD) spectra of aqueous d-glucose and d-galactose were modeled using a theoretical–computational approach combining molecular dynamics (MD) simulations and perturbed matrix method (PMM) calculations, hereafter ter
Externí odkaz:
https://doaj.org/article/72c6b5d4f82c4063b7eaa32502ce276f
Autor:
Andrea Amadei, Massimiliano Aschi
Publikováno v:
Results in Chemistry, Vol 4, Iss , Pp 100305- (2022)
In this paper we apply a recently developed theoretical-computational procedure for modelling the Vibrational Energy Relaxation (VER) of solvated chromophores represented by small inorganic species. In particular we focus our attention on four differ
Externí odkaz:
https://doaj.org/article/f10d509999e14e039c53ac481921ccf5
Publikováno v:
Molecules, Vol 27, Iss 23, p 8135 (2022)
In this paper, we introduce specific approximations to simplify the vibronic treatment in modeling absorption and emission spectra, allowing us to include a huge number of vibronic transitions in the calculations. Implementation of such a simplified
Externí odkaz:
https://doaj.org/article/470d90d24b6045b895562fded6cbffa0
Autor:
Valerio Morlacci, Tonino Caruso, Marco Chiarini, Antonio Arcadi, Massimiliano Aschi, Laura Palombi
Publikováno v:
Molecules, Vol 27, Iss 23, p 8199 (2022)
An electrochemical initiated tandem reaction of anilines with 2-formyl benzonitrile has been developed. Thus, unprecedented 3-N-aryl substituted isoindolinones have been conveniently achieved by constant current electrolysis in a divided cell using c
Externí odkaz:
https://doaj.org/article/d0b0325a08fe4dc6a70bb2e4686db3a0
Publikováno v:
Molecules, Vol 27, Iss 22, p 7863 (2022)
A theoretical-computational procedure based on the quasi-Gaussian entropy (QGE) theory and molecular dynamics (MD) simulations is proposed for the calculation of thermodynamic properties for molecular and supra-molecular species in the gas phase. The
Externí odkaz:
https://doaj.org/article/943d576e09d44c6593863be08ea50ba9
Autor:
Sara Battista, Vincenzo Marsicano, Antonio Arcadi, Luciano Galantini, Massimiliano Aschi, Elena Allegritti, Alessandra Del Giudice, Luisa Giansanti
Publikováno v:
Colloids and Interfaces, Vol 5, Iss 2, p 28 (2021)
The scientific relevance of quinolines is strictly linked to the fine-tuning of their features by functionalizing the heterocyclic core. Consequently, the compounds of this class are very versatile and can be used as possible drugs for a lot of medic
Externí odkaz:
https://doaj.org/article/14ccc90309ae4ae0b96e09dc56d49d45
Publikováno v:
Molecules, Vol 26, Iss 11, p 3111 (2021)
Although natural or artificial modified pyrimidine nucleobases represent important molecules with valuable properties as constituents of DNA and RNA, no systematic analyses of the structural aspects of bromo derivatives of cytosine have appeared so f
Externí odkaz:
https://doaj.org/article/759dbd5419be4de7b28efa25c0e0c89d