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Material Type: Artigo
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Interaction between acetylsalicylic acid and a cationic amphiphile model: An experimental approach using surface techniquesFlores-Sánchez, R. ; Bigorra-Mir, M. ; Gámez, F. ; Lopes-Costa, T. ; Argudo, P.G. ; Martín-Romero, M.T. ; Camacho, L. ; Pedrosa, J.M.Chemical physics letters, 2023-05, Vol.819, p.140450, Article 140450 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Characterization an wooden Pietà sculpture from the XVIII century using XRF and microct techniquesSanches, Francis Anna C.R.A. ; Nardes, Raysa C. ; Santos, Ramon S. ; Gama Filho, Hamilton S. ; Machado, Alessandra S. ; Leitão, Roberta G. ; Leitão, Catarine C.G. ; Calgam, Teresa E. ; Bueno, Regina ; Assis, Joaquim T. ; Oliveira, Davi F. ; Lopes, Ricardo T. ; Anjos, Marcelino J.Radiation physics and chemistry (Oxford, England : 1993), 2023-01, Vol.202, p.110556, Article 110556 [Periódico revisado por pares]Elsevier LtdTexto completo disponível |
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Material Type: Artigo
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Ionic liquids with hydrogenated and perfluorinated chains: Structural study of the [P6,6,6,14][FnCOO] n = 7, 9, 11. Checking the existence of polar – hydrogenated – perfluorinated triphilic continuitySilva, Gonçalo M.C. ; Beira, Maria J. ; Morgado, Pedro ; Branco, Luís C. ; Sebastião, Pedro J. ; Canongia Lopes, José N. ; Filipe, Eduardo J.M.Journal of molecular liquids, 2022-12, Vol.367, p.120506, Article 120506 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Human Learning for Molecular Simulations: The Collective Variables Dashboard in VMDHénin, Jérôme ; Lopes, Laura J. S ; Fiorin, GiacomoJournal of chemical theory and computation, 2022-03, Vol.18 (3), p.1945-1956 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Aqueous solvation study of melatonin using ab initio molecular dynamicsRodrigues, Allane C.C. ; de M. Camargo, Lilian T.F. ; Francisco Lopes, Yago ; Sallum, Lóide O. ; Napolitano, Hamilton B. ; Camargo, Ademir J.Journal of molecular liquids, 2021-12, Vol.343, p.117451, Article 117451 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Avobenzone-loaded and omega-3-enriched lipid formulations for production of UV blocking sunscreen gels and textilesCaldas, Ana R. ; Faria, Maria J. ; Ribeiro, Artur ; Machado, Raul ; Gonçalves, Hugo ; Gomes, Andreia C. ; Soares, Graça M.B. ; Lopes, Carla M. ; Lúcio, MarleneJournal of molecular liquids, 2021-11, Vol.342, p.116965, Article 116965 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Conformational Space, IR-Induced, and UV-Induced Chemistry of Carvacrol Isolated in a Low-Temperature Argon MatrixLopes Jesus, A. J ; Fausto, Rui ; Reva, IgorThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-09, Vol.125 (37), p.8215-8229 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
8 |
Material Type: Artigo
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Theoretical and Spectroscopic Evidence of the Dynamic Nature of Copper Active Sites in Cu-CHA Catalysts under Selective Catalytic Reduction (NH3–SCR–NO x ) ConditionsMillan, Reisel ; Cnudde, Pieter ; Hoffman, Alexander E. J ; Lopes, Christian W ; Concepción, Patricia ; van Speybroeck, Veronique ; Boronat, MercedesThe journal of physical chemistry letters, 2020-12, Vol.11 (23), p.10060-10066 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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UV-induced radical formation and isomerization of 4-methoxyindole and 5-methoxyindoleLopes Jesus, A. J ; Rosado, Mário T. S ; Fausto, R ; Reva, IPhysical chemistry chemical physics : PCCP, 2020-10, Vol.22 (4), p.22943-22955 [Periódico revisado por pares]Cambridge: Royal Society of ChemistryTexto completo disponível |
10 |
Material Type: Artigo
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Kinetically unstable 2–isocyanophenol isolated in cryogenic matrices: Vibrational excitation, conformational changes and spontaneous tunnelingLopes Jesus, A.J. ; Reva, Igor ; Nunes, Cláudio M. ; Roque, José P.L. ; Pinto, Sandra M.V. ; Fausto, RuiChemical physics letters, 2020-05, Vol.747, p.137069, Article 137069 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |