Sfoglia per Chimica e Geologia
Basis set limits of the second order Møller-Plesset correlation energies of water, methane, acetylene, ethylene, and benzene
2007 Yamaki, Daisuke; Koch, Henrik; Ten-No, Seiichiro
Basis-set convergence in correlated calculations on Ne, N2, and H2O
1998 Halkier, Asger; Helgaker, Trygve; Jørgensen, Poul; Klopper, Wim; Koch, Henrik; Olsen, Jeppe; Wilson, Angela K.
Basis-set convergence of correlated calculations on water
1997 Helgaker, Trygve; Klopper, Wim; Koch, Henrik; Noga, Jozef
Benchmark calculations for molecules in the gas phase: stateof- the-art coupled-cluster computations
2010 C., Puzzarini; Barone, Vincenzo
Benchmark Structures and Conformational Landscapes of Amino Acids in the Gas Phase: A Joint Venture of Machine Learning, Quantum Chemistry, and Rotational Spectroscopy
2023 Barone, Vincenzo; Fusè, Marco; Lazzari, Federico; Mancini, Giordano
A benchmark study of electronic excitation energies, transition moments, and excited-state energy gradients on the nicotine molecule
2014 Egidi, Franco; Mireia, Segado; Henrik, Koch; Cappelli, Chiara; Barone, Vincenzo
Benchmarking TD-DFT against vibrationally resolved absorption spectra at room temperature: 7-aminocoumarins as test cases
2015 Muniz-Miranda, F.; Pedone, A.; Battistelli, G.; Montalti, M.; Bloino, J.; Barone, V.
The benzene-argon complex: A ground and excited state ab initio study
1998 Koch, Henrik; Fernández, Berta; Christiansen, Ove
Benzene-argon S-1 intermolecular potential energy surface
1999 Fernandez, B; Koch, H; Makarewicz, J
Benzene-argon triplet intermolecular potential energy surface
2003 López Cacheiro, Javier; Fernández, Berta; Koch, Henrik; Makarewicz, Jan; Hald, Kasper; Jørgensen, Poul
Benzothiazole carboxylic acid (BTCA) vs thiazole carboxylic acid (TTCA) as specific pheomelanin markers: relationship with skin phototype and UV sensitivity
2005 Napolitano, A.; Manini, P.; Panzella, L.; Prizio, E.; Procaccini, Em; Monfrecola, G.; D'Ischia, M.
Benzothiazoles are monomer intermediates in pheomelanogenesis in vitro
2007 DE LUCIA, M.; Panzella, L.; P., Manini; Napolitano, A.; D'Ischia, M.
Benzothiopyranoindole-Based Antiproliferative Agents: Synthesis, Cytotoxicity, Nucleic Acids Interaction, and Topoisomerases Inhibition Properties
2009 L., DALLA VIA; S., MARCIANI MAGNO; O., Gia; A. M., Marini; F., DA SETTIMO; S., Salerno; C., LA MOTTA; F., Simorini; S., Taliani; A., Lavecchia; C., DI GIOVANNI; Brancato, Giuseppe; Barone, Vincenzo; E., Novellino
Bidimensional tandem mass spectrometry for selective identification of nitration sites in proteins
2007 Amoresano, Angela; Chiappetta, Giovanni; Pucci, Piero; D'Ischia, Marco; Marino, Gennaro
Binding of an Indenoisoquinoline to the topoisomerase-DNA complex induces reduction of linker mobility and strengthening of protein-DNA interaction
2012 Mancini, Giordano; D'Annessa, Ilda; Coletta, Andrea; Chillemi, Giovanni; Pommier, Yves; Cushman, Mark; Desideri, Alessandro
Binding of Nucleic Acid Components to the Serpentinite-Hosted Hydrothermal Mineral Brucite
2018 Fornaro, Teresa; Brucato, John Robert; Feuillie, Cécile; Sverjensky, Dimitri A.; Hazen, Robert M.; Brunetto, Rosario; D'Amore, Maddalena; Barone, Vincenzo
Binding of SARS-CoV-2 to cell receptors: a tale of molecular evolution
2021 Gomez, Santiago A; Rojas-Valencia, Natalia; Gomez, Sara; Egidi, Franco; Cappelli, Chiara; Restrepo, Albeiro
Biochemical grounds for "crosslinker sensitivity": What have we learned from pharmacology?
2015 Pagano, Giovanni; D'Ischia, Marco; Pallardó, Federico V.
Biodegradable passion fruit-like nano-architectures as carriers for cisplatin prodrug
2016 Cassano, Domenico; Santi, Melissa; Cappello, Valentina; Luin, Stefano; Signore, Giovanni; Voliani, Valerio
Biodegradable Ultrasmall-In-Nano Architectures Loaded with Cisplatin Prodrug in Combination with Ionizing Radiation Induces DNA Damage and Apoptosis in Pancreatic Ductal Adenocarcinoma
2022 Che, Pei Pei; Mapanao, Ana Katrina; Gregori, Alessandro; Ermini, Maria Laura; Zamborlin, Agata; Capula, Mjriam; Ngadimin, Danitsja; Slotman, Ben J.; Voliani, Valerio; Sminia, Peter; Giovannetti, Elisa
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