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Repositório Aberto da Universidade do Porto
Browsing by Author Miguel Jorge
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Showing results 1 to 20 of 28
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Issue Date
Title
Author(s)
Type
2009
1-Octanol/water partition coefficients of n-Alkanes from molecular simulations of absolute solvation free energies
Nuno M. Garrido
;
António J. Queimada
;
Miguel Jorge
;
Eugénia A. Macedo
;
Ioannis G. Economou
Artigo em Revista Científica Internacional
2010
A critical assessment of methods for the intrinsic analysis of liquid interfaces. 1. surface site distributions
Miguel Jorge
;
Pal Jedlovszky
;
M. Natália D. S. Cordeiro
Artigo em Revista Científica Internacional
2010
A Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces: 2. Density Profiles
Miguel Jorge
;
György Hantal
;
Pál Jedlovszky
;
M. Natalia D. S. Cordeiro
Artigo em Revista Científica Internacional
2009
Adsorption of propane,propylene and isobutane on a metal-organic framework : molecular simulation and experiment
Nabil Lamia
;
Miguel Jorge
;
Miguel A. Granato
;
Filipe A. Almeida Paz
;
Hubert Chevreau
;
Alírio E. Rodrigues
Artigo em Revista Científica Internacional
2010
Diffusion of propane, propylene and isobutane in 13X zeolite by molecular dynamics
Miguel A. Granato
;
Miguel Jorge
;
Thijs J.H. Vlugt
;
Alírio E. Rodrigues
Artigo em Revista Científica Internacional
2010
Effect of the integration method on the accuracy and computational efficiency of free energy calculations using thermodynamic integration
Miguel Jorge
;
Nuno M. Garrido
;
António J. Queimada
;
Ioannis G. Economou
;
Eugénia A. Macedo
Artigo em Revista Científica Internacional
2007
Evaluation of the lipophilic properties of opiolds, amphetamine-like drugs, and metabolites through electrochemical studies at the interface between two immiscible solutions
Rubin Gulaboski
;
Natalia N D S Cordeiro
;
Nuno Milhazes
;
Jorge Garrido
;
Fernanda Borges
;
Miguel Jorge
;
Carlos M Pereira
;
Ivan Bogeski
;
Aluska Helguera Morales
;
Blaze Naumoski
;
Fernando F Silva
Artigo em Revista Científica Internacional
2014
From molecules to processes: Molecular simulations applied to the design of simulated moving bed for ethane/ethylene separation
Miguel Angelo Granato
;
Vanessa Duarte Martins
;
João Carlos Santos
;
Miguel Jorge
;
Alírio Egídio Rodrigues
Artigo em Revista Científica Internacional
2008
Gas-phase molecular structure and energetics of anionic silicates
Jose R B Gomes
;
Natalia N D S Cordeiro
;
Miguel Jorge
Artigo em Revista Científica Internacional
2014
Interaction of chitosan and chitin with Ni, Cu and Zn ions: A computational study
Jose R B Gomes
;
Miguel Jorge
;
Paula Gomes
Artigo em Revista Científica Internacional
2007
Intrinsic structure and dynamics of the water/nitrobenzene interface
Miguel Jorge
;
Natalia N D S Cordeiro
Artigo em Revista Científica Internacional
2006
Modelling the thermal stability of precursor nanoparticles in zeolite synthesis
Miguel Jorge
;
Scott M. Auerbach
;
Peter A. Monson
Artigo em Revista Científica Internacional
2008
Molecular dynamics simulation of self-assembly of n-decyltrimethylammonium bromide micelles
Miguel Jorge
Artigo em Revista Científica Internacional
2009
Molecular Dynamics Simulation of the Early Stages of the Synthesis of Periodic Mesoporous Silica
Miguel Jorge
;
Jose R B Gomes
;
M Natalia D S Cordeiro
;
Nigel A Seaton
Artigo em Revista Científica Internacional
2008
Molecular dynamics study of the interface between water and 2-nitrophenyl octyl ether
Miguel Jorge
;
Natalia N D S Cordeiro
Artigo em Revista Científica Internacional
2009
Molecular simulation of absolute hydration free energies of polar compounds
Nuno M. Garrido
;
António J. Queimada
;
Miguel Jorge
;
Ioannis G. Economou
;
Maria Eugénia Macedo
Artigo em Livro de Atas de Conferência Internacional
2010
Molecular simulation of propane/propylene separation on the metal-organic framework CuBTC
Miguel Jorge
;
Nabil Lamia
;
Alírio E. Rodrigues
Artigo em Revista Científica Internacional
2007
Molecular simulation of silica/surfactant self-assembly in the synthesis of periodic mesoporous silicas
Miguel Jorge
;
Jos R B Gomes
;
Natalia, M
;
Cordeiro, DS
;
Nigel A Seaton
Artigo em Revista Científica Internacional
2009
Molecular Simulation of the Hydration Free Energies of Substituted Barbiturates
Nuno M. Garrido
;
Miguel Jorge
;
António J. Queimada
;
Ioannis G. Economou
;
Maria Eugénia Macedo
Artigo em Livro de Atas de Conferência Internacional
2010
Molecular simulation of the hydration Gibbs energy of barbiturates
Nuno M. Garrido
;
Miguel Jorge
;
António J. Queimada
;
Ioannis G. Economou
;
Eugénia A. Macedo
Artigo em Revista Científica Internacional