Sfoglia per ???browse.type.metadata.discipline??? Chimica e Geologia
Eumelanin-Based Organic Bioelectronics: Myth or Reality?
2016 Barra, Mario; Bonadies, Irene; Carfagna, Cosimo; Cassinese, Antonio; Cimino, Francesca; Crescenzi, Orlando; Criscuolo, Valeria; D'Ischia, Marco; Maglione, Maria Grazia; Manini, Paola; Migliaccio, Ludovico; Musto, Anna; Napolitano, Alessandra; Navarra, Angelica; Panzella, Lucia; Parisi, Silvia; Pezzella, Alessandro; Prontera, Carmela Tania; Tassini, Paolo
Evaluation of Chemical Diversity of Biotinylated Chiral 1,3-Diamines as a Catalytic Moiety in Artificial Imine Reductase
2016 Pellizzoni, Michela; Facchetti, Giorgio; Gandolfi, Raffaella; Fusè, Marco; Contini, Alessandro; Rimoldi, Isabella
Evaluation of Hyperpolarizability from the Solvatochromic Method: Thiophene Containing Push–Pull Cationic Dyes as a Case Study
2018 Carlotti, Benedetta; Cesaretti, Alessio; Cannelli, Oliviero; Giovannini, Tommaso; Cappelli, Chiara; Bonaccorso, Carmela; Fortuna, Cosimo G.; Elisei, Fausto; Spalletti, Anna
Evidence for sevenfold coordination in the first solvation shell of Hg(II) aqua ion
2007 G., Chillemi; Mancini, Giordano; N., Sanna; Barone, Vincenzo; S., DELLA LONGA; M., Benfatto; N. V., Pavel; P., D'Angelo
Evidence of the crucial role of the linker domain on the catalytic activity of human topoisomerase I by experimental and simulative characterization of the Lys681Ala mutant
2009 Fiorani, P; Tesauro, C; Mancini, Giordano; Chillemi, G; D'Annessa, I; Graziani, G; Tentori, L; Muzi, A; Desideri, A.
Evidence of variable H-bonding networksw embedding nitroxide free-radicals in protic solvents
2006 M., Pavone; A., Sillampa; P., Cimino; O., Crescenzi; Barone, Vincenzo
Evidences of long lived cages in functionalized polymers: Effects on chromophore dynamic and spectroscopic properties
2014 Giacomo, Prampolini; Susanna, Monti; DE MITRI, Nicola; Barone, Vincenzo
Evolution of Bonding During the Insertion of Anionic Ibuprofen Into Model Cell Membranes
2019 Rojas-Valencia, Natalia; Gomez, Sara; Montillo, Sebastian; Manrique-Moreno, Marcela; Cappelli, Chiara; Hadad, Cacier Zilahy; Restrepo, Albeiro
Evolving approaches in glioma treatment: harnessing the potential of copper metabolism modulation
2023 Cazzoli, R.; Zamborlin, Agata; Ermini, M. L.; Salerno, A.; Curcio, M.; Nicoletta, F. P.; Iemma, F.; Vittorio, Orazio; Voliani, Valerio; Cirillo, G.
Exchange functionals with improved long range behaviour and adiabatic correction method without adjustable parameters.
1998 Adamo, C; Barone, Vincenzo
Excitation dynamics in hetero-bichromophoric calixarene systems
2016 Tosi, Irene; SEGADO CENTELLAS, Mireia; Campioli, Elisa; Iagatti, Alessandro; Lapini, Andrea; Sissa, Cristina; Baldini, Laura; Cappelli, Chiara; Di Donato, Mariangela; Sansone, Francesco; Santoro, Fabrizio; Terenziani, Francesca
Excitation energies from the coupled cluster singles and doubles linear response function (CCSDLR). Applications to Be, CH+, CO, and H2O
1990 Koch, Henrik; Jensen, Hans Jørgen Aa.; Jørgensen, Poul; Helgaker, Trygve
Excitation energies of BH, CH2 and Ne in full configuration interaction and the hierarchy CCS, CC2, CCSD and CC3 of coupled cluster models
1995 Koch, Henrik; Christiansen, Ove; Jørgensen, Poul; Olsen, Jeppe
Excitation energies of H2O, N2 and C2 in full configuration interaction and coupled cluster theory
1996 Christiansen, Ove; Koch, Henrik; Jørgensen, Poul; Olsen, Jeppe
The excited state decay of the A-T DNA: a PCM/DFT study in aqueous solution of the (9-methyl-adenine)2-(1-methyl-thymine)2 stacked tetramer
2009 F., Santoro; Barone, Vincenzo; R., Improta
Excited states behavior of nucleobases in solution: insights from computational studies
2015 Improta, Roberto; Barone, Vincenzo
Excited states properties of sizable molecules in solution: from structure to reactivity
2007 F., Santoro; Barone, Vincenzo; C., Benzi; R., Improta
Excited-State Proton-Transfer Processes of DHICA Resolved: From Sub-Picoseconds to Nanoseconds
2013 Corani, A; Pezzella, Alessandro; Pascher, T; Gustavsson, T; Markovitsi, D; Huijser, A; D'Ischia, Marco; Sundstrom, V.
Existence of energy minimums for thin elastic rods in static helical configurations
2009 M., Argeri; Barone, Vincenzo; S., DE LILLO; G., Lupo; M., Sommacal
Expanding the Chemical Space of Tetracyanobuta-1,3-diene (TCBD) through a Cyano-Diels-Alder Reaction: Synthesis, Structure, and Physicochemical Properties of an Anthryl-fused-TCBD Derivative
2021 Mateo, L. M.; Sagresti, L.; Luo, Y.; Guldi, D. M.; Torres, T.; Brancato, G.; Bottari, G.
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