A comparative study of the hydration of and with refined polarizable model potentials M Carrillo-Tripp, H Saint-Martin, I Ortega-Blake The Journal of Chemical Physics 118 (15), 7062-7073, 2003 | 196 | 2003 |
A mobile charge densities in harmonic oscillators (MCDHO) molecular model for numerical simulations: the water–water interaction H Saint-Martin, J Hernández-Cobos, MI Bernal-Uruchurtu, I Ortega-Blake, ... The Journal of Chemical Physics 113 (24), 10899-10912, 2000 | 154 | 2000 |
A refined Monte Carlo study of Mg2+ and Ca2+ hydration MI Bernal‐Uruchurtu, I Ortega‐Blake The Journal of chemical physics 103 (4), 1588-1598, 1995 | 123 | 1995 |
On the role of sterol in the formation of the amphotericin B channel BV Cotero, S Rebolledo-Antúnez, I Ortega-Blake Biochimica et Biophysica Acta (BBA)-Biomembranes 1375 (1-2), 43-51, 1998 | 121 | 1998 |
Effective group potentials. 1. Method R Poteau, I Ortega, F Alary, AR Solis, JC Barthelat, JP Daudey The Journal of Physical Chemistry A 105 (1), 198-205, 2001 | 89 | 2001 |
Amphotericin B channels in the bacterial membrane: role of sterol and temperature B Venegas, J González-Damián, H Celis, I Ortega-Blake Biophysical journal 85 (4), 2323-2332, 2003 | 88 | 2003 |
Minimalist molecular model for nanopore selectivity M Carrillo-Tripp, H Saint-Martin, I Ortega-Blake Physical review letters 93 (16), 168104, 2004 | 73 | 2004 |
Nonadditivity in an analytical intermolecular potential: The water–water interaction H Saint‐Martin, C Medina‐Llanos, I Ortega‐Blake The Journal of chemical physics 93 (9), 6448-6452, 1990 | 71 | 1990 |
A molecular orbital study of the hydration of ions. The role of nonadditive effects in the hydration shells around Mg2+ and Ca2+ I Ortega‐Blake, O Novaro, A Leś, S Rybak The Journal of Chemical Physics 76 (11), 5405-5413, 1982 | 67 | 1982 |
A microscopic electrostatic model for the amphotericin B channel M Bonilla-Marín, M Moreno-Bello, I Ortega-Blake Biochimica et Biophysica Acta (BBA)-Biomembranes 1061 (1), 65-77, 1991 | 59 | 1991 |
Effect of membrane structure on the action of polyenes: I. Nystatin action in cholesterol-and ergosterol-containing membranes KS Récamier, A Hernández-Gómez, J González-Damián, I Ortega-Blake The Journal of membrane biology 237 (1), 31-40, 2010 | 58 | 2010 |
Cell penetrating peptides and cationic antibacterial peptides: two sides of the same coin. DRG Rodriguez Plaza JG1, Morales-Nava R2, Diener C1, Schrei G, Gonzalez ZD ... Journal of Biological Chemistry 289 (21), 14448, 2014 | 55 | 2014 |
Ion hydration in nanopores and the molecular basis of selectivity M Carrillo-Tripp, ML San-Román, J Hernańdez-Cobos, H Saint-Martin, ... Biophysical Chemistry 124 (3), 243-250, 2006 | 53 | 2006 |
A refined Monte Carlo study of aqueous urea solutions J Hernández‐Cobos, I Ortega‐Blake, M Bonilla‐Marín, M Moreno‐Bello The Journal of chemical physics 99 (11), 9122-9134, 1993 | 53 | 1993 |
Development of first-principles interaction model potentials. An application to the study of the bromide hydration R Ayala, JM Martınez, RR Pappalardo, H Saint-Martı́n, I Ortega-Blake, ... The Journal of chemical physics 117 (23), 10512-10524, 2002 | 50 | 2002 |
Coupling a polarizable water model to the hydrated ion–water interaction potential: A test on the hydration JM Martı́nez, J Hernández-Cobos, H Saint-Martin, RR Pappalardo, ... The Journal of Chemical Physics 112 (5), 2339-2347, 2000 | 49 | 2000 |
The role of nonadditive effects in the second hydration shell of Mg2+ and Ca2+. A molecular orbital study of the three‐body potential energy surface I Ortega‐Blake, J Hernandez, O Novaro The Journal of chemical physics 81 (4), 1894-1900, 1984 | 42 | 1984 |
Many-body forces and electron correlation in small metal clusters IG Kaplan, J Hernández-Cobos, I Ortega-Blake, O Novaro Physical Review A 53 (4), 2493, 1996 | 39 | 1996 |
Toward an Understanding of the Hydrolysis of Mg−PPi. An ab Initio Study of the Isomerization Reactions of Neutral and Anionic Mg−Pyrophosphate Complexes H Saint-Martin, LE Ruiz-Vicent, A Ramírez-Solís, I Ortega-Blake Journal of the American Chemical Society 118 (48), 12167-12173, 1996 | 37 | 1996 |
An amphotericin B derivative equally potent to amphotericin B and with increased safety A Antillón, AH De Vries, M Espinosa-Caballero, JM Falcón-González, ... PLoS One 11 (9), e0162171, 2016 | 36 | 2016 |