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Solvation
37
"Exhaustive rotamer search of the 4C1 conformation of α- and β-D-galactopyranose" (2017) Del Vigo, E.A.; Marino, C.; Stortz, C.A. Carbohydrate Research. 448:136-147
"Tyrosine oxidation and nitration in transmembrane peptides is connected to lipid peroxidation" (2017) Bartesaghi, S.;Herrera, D.;Martinez, D.M. (...)Radi, R. Archives of Biochemistry and Biophysics. 622:9-25
"Solvation and Proton-Coupled Electron Transfer Reduction Potential of 2NO• to 1HNO in Aqueous Solution: A Theoretical Investigation" (2017) Venâncio, M.F.; Doctorovich, F.; Rocha, W.R. Journal of Physical Chemistry B. 121(27):6618-6625
"A conductivity study of preferential solvation of lithium ion in acetonitrile-dimethyl sulfoxide mixtures" (2015) Mozhzhukhina, N.; Longinotti, M.P.; Corti, H.R.; Calvo, E.J. Electrochimica Acta. 154:456-461
"Isotopic Preferential Solvation of I- in Low-Temperature Water Nanoclusters" (2015) Videla, P.E.; Rossky, P.J.; Laria, D. Journal of Physical Chemistry B. 119(35):11783-11790
"Lithium solvation in dimethyl sulfoxide-acetonitrile mixtures" (2014) Semino, R.; Zaldívar, G.; Calvo, E.J.; Laria, D. Journal of Chemical Physics. 141(21)
"Assessing the accuracy of the SIRAH force field to model DNA at coarse grain level" (2013) Dans, P.D.;Darré, L.;Machado, M.R. (...)Pantano, S. 8th Brazilian Symposium on Bioinformatics, BSB 2013. 8213 LNBI:71-81
"A quantum molecular dynamics study of aqueous solvation dynamics" (2013) Videla, P.E.; Rossky, P.J.; Laria, D. Journal of Chemical Physics. 139(16)
"Excess protons in water-acetone mixtures" (2012) Semino, R.; Laria, D. Journal of Chemical Physics. 136(19)
"Excess protons in mesoscopic water-acetone nanoclusters" (2012) Semino, R.; Martí, J.; Guàrdia, E.; Laria, D. Journal of Chemical Physics. 137(19)
"Liquid methanol confined within functionalized silica nanopores. 2. Solvation dynamics of coumarin 153" (2011) Elola, M.D.; Rodriguez, J.; Laria, D. Journal of Physical Chemistry B. 115(44):12859-12867
"Near-critical and supercritical dilute solutions viewed from macroscopic and molecular-scale perspectives" (2010) Fernández-Prini, R.; Laura Japas, M.; Marceca, E. Journal of Supercritical Fluids. 55(2):472-478
"Near-critical and supercritical dilute solutions viewed from macroscopic and molecular-scale perspectives" (2010) Fernández-Prini, R.; Laura Japas, M.; Marceca, E. Journal of Supercritical Fluids. 55(2):472-478
"Carbohydrate-binding proteins: Dissecting ligand structures through solvent environment occupancy" (2009) Gauto, D.F.;Di Lella, S.;Guardia, C.M.A. (...)Martí, M.A. Journal of Physical Chemistry B. 113(25):8717-8724
"Exploring the picosecond time domain of the solvation dynamics of coumarin 153 within β-cyclodextrins" (2008) Rodriguez, J.; Martí, J.; Guardia, E.; Laria, D. Journal of Physical Chemistry B. 112(30):8990-8998
"Confinement of polar solvents within β-cyclodextrins" (2008) Rodriguez, J.; Rico, D.H.; Domenianni, L.; Laria, D. Journal of Physical Chemistry B. 112(25):7522-7529
"Structural and dynamical characteristics of mesoscopic H+[H2O]n clusters" (2007) Galvagno, M.; Laria, D.; Rodriguez, J. Journal of Molecular Liquids. 136(3):317-322
"Protons in non-ionic aqueous reverse micelles" (2007) Rodriguez, J.; Martí, J.; Guàrdia, E.; Laria, D. Journal of Physical Chemistry B. 111(17):4432-4439
"Solubility of crystalline alkali metal iodides in supercritical ammonia" (2005) Sciaini, G.; Marceca, E.; Fernández-Prini, R. Journal of Supercritical Fluids. 35(2):106-110
"Solubility of crystalline alkali metal iodides in supercritical ammonia" (2005) Sciaini, G.; Marceca, E.; Fernández-Prini, R. Journal of Supercritical Fluids. 35(2):106-110
"Solvation of Coumarin 314 at water/air interfaces containing anionic surfactants. I. Low coverage" (2005) Pantano, D.A.; Sonoda, M.T.; Skaf, M.S.; Laria, D. Journal of Physical Chemistry B. 109(15):7365-7372
"Fluorescence of 4-aminophthalimide in supercritical CO 2-ethanol mixtures" (2004) Wetzler, D.E.; Fernández-Prini, R.; Aramendía, P.F. Chemical Physics. 305(1-3):27-36
"Fluorescence of 4-aminophthalimide in supercritical CO 2-ethanol mixtures" (2004) Wetzler, D.E.; Fernández-Prini, R.; Aramendía, P.F. Chemical Physics. 305(1-3):27-36
"Solvatipn of excess electrons in supercritical ammonia" (2003) Rodriguez, J.; Skaf, M.S.; Laria, D. Journal of Chemical Physics. 119(12):6044-6052
"Solvent effects on nuclear magnetic resonance 2J(C,Hf) and 1J(C,Hf) spin-spin coupling constantsinacetaldehyde" (2003) Zaccari, D.;Barone, V.;Peralta, J.E. (...)Esteban, A. International Journal of Molecular Sciences. 4(3):93-106
"Molecular dynamics study of solvation of Coumarin-314 at the water/air interface" (2003) Pantano, D.A.; Laria, D. Journal of Physical Chemistry B. 107(13):2971-2977
"Reaction pathways of 2,2,2-trifluoroethylamine and n-butylamine with [Ru(bpy)2(NO)Cl]2+" (2002) Di Salvo, F.; Crespo, A.; Estrin, D.A.; Doctorovich, F. Tetrahedron. 58(21):4237-4244
"Molecular structure effects on the kinetics of hydroxyl radical addition to azo dyes" (2002) Destaillats, H.; Turjanski, A.G.; Estrin, D.A.; Hoffmann, M.R. Journal of Physical Organic Chemistry. 15(5):287-292
"Structure, solvation, and bonding in pentacyano(L) ferrate (II) ions (L=aliphatic amine): A density functional study" (2001) Gonz ález-Lebrero, M.C.; Turjanski, A.G.; Olabe, J.A.; Estrin, D.A. Journal of Molecular Modeling. 7(7):201-206
"Dynamic solvatochromism in solvent mixtures" (2001) Wetzler, D.E.; Chesta, C.; Fernández-Prini, R.; Aramendía, P.F. Pure and Applied Chemistry. 73(3):405-409
"Diffusion coefficients of iodide in high temperature aqueous solutions" (2000) Trevani, L.N.; Calvo, E.; Corti, H.R. Electrochemistry Communications. 2(5):312-316
"Diffusion coefficients of iodide in high temperature aqueous solutions" (2000) Trevani, L.N.; Calvo, E.; Corti, H.R. Electrochemistry Communications. 2(5):312-316
"Concertedness and solvent effects in multiple proton transfer reactions: the formic acid dimer in solution" (2000) Kohanoff, J.;Koval, S.;Estrin, D.A. (...)Abashkin, Y. Journal of Chemical Physics. 112(21):9498-9508
"Aqueous nonionic solutes at infinite dilution: Thermodynamic description, including the near-critical region" (2000) Alvarez, J.L.; Fernandez-Prini, R.; Japas, M.L. Industrial and Engineering Chemistry Research. 39(10):3625-3630