Navegar

Colección

Datos Estadísticas

Lista de

Conformations
51
"Long-range anisotropic effects in a V–shaped Tröger's base diformanilide: Conformational study by NMR assignment and DFT calculations" (2018) Trupp, L.;Laurella, S.L.;Tettamanzi, M.C. (...)Bruttomesso, A.C. Journal of Molecular Structure. 1157:434-443
"Hidden Structural Codes in Protein Intrinsic Disorder" (2017) Borkosky, S.S.;Camporeale, G.;Chemes, L.B. (...)De Prat Gay, G. Biochemistry. 56(41):5560-5569
"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
"Multifunctional Cytochrome c: Learning New Tricks from an Old Dog" (2017) Alvarez-Paggi, D.;Hannibal, L.;Castro, M.A. (...)Murgida, D.H. Chemical Reviews. 117(21):13382-13460
"Molecular conformation of linear alkane molecules: From gas phase to bulk water through the interface" (2017) Murina, E.L.; Fernández-Prini, R.; Pastorino, C. Journal of Chemical Physics. 147(6)
"Conformational and structural diversity of iridium dimethyl sulfoxide complexes" (2017) Ridgway, B.M.;Foi, A.;Corrêa, R.S. (...)Di Salvo, F. Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials. 73(6)
"Structural Study of a Flexible Active Site Loop in Human Indoleamine 2,3-Dioxygenase and Its Functional Implications" (2016) Álvarez, L.;Lewis-Ballester, A.;Roitberg, A. (...)Capece, L. Biochemistry. 55(19):2785-2793
"Binding of the substrate UDP-glucuronic acid induces conformational changes in the xanthan gum glucuronosyltransferase" (2016) Salinas, S.R.;Petruk, A.A.;Brukman, N.G. (...)Ielpi, L. Protein Engineering, Design and Selection. 29(6):197-207
"Underlying Thermodynamics of pH-Dependent Allostery" (2014) Di Russo, N.V.; Martí, M.A.; Roitberg, A.E. Journal of Physical Chemistry B. 118(45):12818-12826
"Hydrophobic effect drives oxygen uptake in myoglobin via histidine E7" (2013) Boechi, L.;Arrar, M.;Martí, M.A. (...)Estrin, D.A. Journal of Biological Chemistry. 288(9):6754-6762
"Ring opening/closure reactions of novel diheteroarylethenes derivatives. Solvent effects" (2012) Vazquez, A.J.; Nudelman, N.S. Journal of Physical Organic Chemistry. 25(11):925-932
"ATP and Mg2+ promote the reversible oligomerization and aggregation of chloroplast 2-Cys peroxiredoxin" (2011) Aran, M.;Ferrero, D.;Wolosiuk, A. (...)Wolosiuk, R.A. Journal of Biological Chemistry. 286(26):23441-23451
"Interconversion study in 1,4-substituted six-membered cyclohexane-type rings. structure and dynamics of trans -1,4-dibromo-1,4-dicyanocyclohexane" (2011) Bain, A.D.;Baron, M.;Burger, S.K. (...)Rodríguez, M.B. Journal of Physical Chemistry A. 115(33):9207-9216
"Conformational pathways of simple six-membered rings" (2010) Stortz, C.A. Journal of Physical Organic Chemistry. 23(12):1173-1186
"Modeling the effects of molecule distortion on the Kondo resonance in the conductance of CoPc/Au(111) and TBrPP-Co/Cu(111)" (2009) Aguiar-Hualde, J.M.;Chiappe, G.;Louis, E. (...)Simonin, J. Physica Status Solidi (A) Applications and Materials Science. 206(10):2217-2227
"Conformational and electronic effects on the regioselectivity of the glycosylation of different anomers of N-dimethylmaleoyl-protected glucosamine acceptors" (2008) Bohn, M.L.; Colombo, M.I.; Rúveda, E.A.; Stortz, C.A. Organic and Biomolecular Chemistry. 6(3):554-561
"Experimental and theoretical study of the proton methoxy chemical shifts of substituted 3,4-dimethoxyphenethylamines and maleimide/phthalimide derivatives" (2008) Vitale, A.A.;Stahl, A.E.;Cecilia dos Santos Claro, P. (...)Jubert, A.H. Journal of Molecular Structure. 881(1-3):167-174
"Disaccharide conformational maps: Adiabaticity in analogues with variable ring shapes" (2008) Stortz, C.A.; French, A.D. Molecular Simulation. 34(4):373-389
"Molecular theory of chemically modified electrodes by redox polyelectrolytes under equilibrium conditions: Comparison with experiment" (2008) Tagliazucchi, M.; Calvo, E.J.; Szleifer, I. Journal of Physical Chemistry C. 112(2):458-471
"A spectroscopic study of the temperature induced modifications on ferredoxin folding and iron-sulfur moieties" (2007) Todorovic, S.;Leal, S.S.;Salgueiro, C.A. (...)Gomes, C.M. Biochemistry. 46(37):10733-10738
"Dynamical regulation of ligand migration by a gate-opening molecular switch in truncated hemoglobin-N from Mycobacterium tuberculosis" (2007) Bidon-Chanal, A.; Martí, M.A.; Estrin, D.A.; Luque, F.J. Journal of the American Chemical Society. 129(21):6782-6788
"A comparative study of the influence of some protecting groups on the reactivity of d-glucosamine acceptors with a galactofuranosyl donor" (2006) Bohn, M.L.; Colombo, M.I.; Stortz, C.A.; Rúveda, E.A. Carbohydrate Research. 341(9):1096-1104
"Nitric oxide interaction with cytochrome c′ and its relevance to guanylate cyclase. Why does the iron histidine bond break?" (2005) Martí, M.A.;Capece, L.;Crespo, A. (...)Estrin, D.A. Journal of the American Chemical Society. 127(21):7721-7728
"NMR J(13C,13C) spin-spin coupling constants in pyridine-carboxaldehydes. Experimental and DFT-B3LYP studies" (2005) Taurian, O.E.; De Kowalewski, D.G.; Pérez, J.E.; Contreras, R.H. Journal of Molecular Structure. 754(1-3):1-9
"Modeling ring puckering in strained systems: Application to 3,6-anhydroglycosides" (2005) Navarro, D.A.; Stortz, C.A. Carbohydrate Research. 340(12):2030-2038
"Synthesis of 6,19-sulfamidate bridged pregnanes" (2005) Duran, F.J.;Ghini, A.A.;Dauban, P. (...)Burton, G. Journal of Organic Chemistry. 70(21):8613-8616
"Ab initio study of NMR 15N chemical shift differences induced by Ca2+ binding to EF-hand proteins" (2004) Biekofsky, R.R.;Turjanski, A.G.;Estrin, D.A. (...)Pastore, A. Biochemistry. 43(21):6554-6564
"Pulsed electric fields effects on the molecular structure and gelation of β-lactoglobulin concentrate and egg white" (2004) Perez, O.E.; Pilosof, A.M.R. Food Research International. 37(1):102-110
"Trans-1,4-dibromocyclohexane-1,4-dicarboxylic acid" (2003) Echeverría, G.A.; Goeta, A.; Barón, M.; Punte, G. Acta Crystallographica Section E: Structure Reports Online. 59(7):o959-o961
"MM3 Potential energy surfaces of the 2-linked glucosyl trisaccharides α-kojitriose and β-sophorotriose" (2003) Stortz, C.A.; Cerezo, A.S. Carbohydrate Research. 338(16):1679-1689
"6,19-carbon-bridged steroids. Synthesis of 6,19-methano-progesterone" (2003) Joselevich, M.; Ghini, A.A.; Burton, G. Organic and Biomolecular Chemistry. 1(6):939-943
"Cleavage of cyclopropyl ketones mediated by alkylmercury(II) hydrides" (2002) Di Chenna, P.H.; André Ferrara; Ghini, A.A.; Burton, G. Journal of the Chemical Society. Perkin Transactions 1. 2(2):227-231
"A pyrazine bis-adduct of a binuclear rhodium(II) carboxylate containing 3,4,5-triethoxybenzoate as the equatorial ligand" (2002) Castro, M.A.;Chaia, Z.D.;Piro, O.E. (...)Rusjan, M. Acta Crystallographica Section C: Crystal Structure Communications. 58(7):m393-m395
"Disaccharide conformational maps: 3D contours or 2D plots?" (2002) Stortz, C.A.; Cerezo, A.S. Carbohydrate Research. 337(20):1861-1871
"Angular dependence of spin-spin coupling constants" (2000) Contreras, R.H.; Peralta, J.E. Progress in nuclear magnetic resonance spectroscopy. 37(4):321-425
"Configurational assignments of diastereomeric γ-lactones using vicinal H-H NMR coupling constants and molecular modelling" (2000) Stortz, C.A.; Maier, M.S. Journal of the Chemical Society. Perkin Transactions 2(9):1832-1836
"Alkali modification of carrageenans. Part IV. Porphyrans as model compounds" (2000) Noseda, M.D.; Viana, A.G.; Duarte, M.E.R.; Cerezo, A.S. Carbohydrate Polymers. 42(3):301-305
"N-nitrosomelatonin" (2000) Turjanski, A.;Chaia, Z.D.;Doctorovich, F. (...)Piro, O.E. Acta Crystallographica, Section C: Crystal Structure Communications. 56(6):682-683
"Analysis of the variation of molecular parameters of NR during vulcanization in the frame of the conformational tube model" (1997) Marzocca, A.J.; Cerveny, S.; Raimondo, R.B. Journal of Applied Polymer Science. 66(6):1085-1092
"2,4-dinitro-N,N-methylphenylaniline" (1997) Ellena, J.; Punte, G.; Nudelman, N.S. Acta Crystallographica Section C: Crystal Structure Communications. 53(12):1930-1932
"2,4-Dinitrophenyl phenyl sulfone" (1996) Ellena, J.; Punte, G.; Nudelman, N.S. Acta Crystallographica Section C: Crystal Structure Communications. 52(11):2929-2932
"IR response of poly(o-toluidine): Spectral modifications upon redox state change" (1996) Andrade, E.M.; Molina, F.V.; Florit, M.I.; Posadas, D. Journal of Electroanalytical Chemistry. 419(1):15-21