Publications

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2009

Comparison of molecular dynamics and superfamily spaces of protein domain deformation

JA. Velázquez-Muriel, M. Rueda, I. Cuesta, A. Pascual-Montano, M. Orozco, and JM. Carazo
Solvation enthalpies of neutral solutes in water and octanol

A. Bidon-Chanal, O. Huertas, M. Orozco, and F J. Luque
On the performance of continuum solvation methods. A comment on Universal Approaches to Solvation Modeling

A. Klamt, B. Mennucci, J. Tomasi, V. Barone, C. Curutchet, M. Orozco, and F J. Luque
An atomistic view to the gas phase proteome

T. Meyer, X. de la Cruz, and M. Orozco
X-Pol Potential: An Electronic Structure-Based Force Field for Molecular Dynamics Simulation of a Solvated Protein in Water

W. Xie, M. Orozco, D. Truhlar, and J. Gao
Ab initio study of the structural, tautomeric, pairing, and electronic properties of seleno-derivatives of thymine

A. Vázquez-Mayagoitia, O. Huertas, M. Fuentes-Cabrera, B. G. Sumpter, M. Orozco, and F J. Luque
COCO: A simple tool to enrich the representation of conformational variability in NMR structures

C. Laughton, M. Orozco, and W. Vranken
Analysis of a long-term dataset of global and diffuse horizontal irradiance at northeastern Spain for energy applications

A. Rincón, O. Jorba, and J. M. Baldasano
Implementation of an online chemical mechanism within a global-regional atmospheric model: design and initial steps

O. Jorba, C. Pérez, and J. M. Baldasano
Assessing the impact of the fortcoming decrease in diesel exhaust particulate matter emissions on air quality: implications for black carbon concentrations in ambient air

Y. González, S. Rodríguez, E. Cuevas, R. Ramos, J. Abreu-Afonso, and J. M. Baldasano

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