Miguel Angelo da Silva Jorge
AuthID: R-000-D6X
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TITLE: Predicting hydration Gibbs energies of alkyl-aromatics using molecular simulation: a comparison of current force fields and the development of a new parameter set for accurate solvation data Full Text
AUTHORS: Nuno M Garrido; Miguel Jorge; Antonio J Queimada; Jose R B Gomes ; Ioannis G Economou; Eugenia A Macedo ;
PUBLISHED: 2011, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 13, ISSUE: 38
AUTHORS: Nuno M Garrido; Miguel Jorge; Antonio J Queimada; Jose R B Gomes ; Ioannis G Economou; Eugenia A Macedo ;
PUBLISHED: 2011, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 13, ISSUE: 38
52
TITLE: What does an ionic liquid surface really look like? Unprecedented details from molecular simulations Full Text
AUTHORS: Gyoergy Hantal; Natalia N D S Cordeiro ; Miguel Jorge;
PUBLISHED: 2011, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 13, ISSUE: 48
AUTHORS: Gyoergy Hantal; Natalia N D S Cordeiro ; Miguel Jorge;
PUBLISHED: 2011, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 13, ISSUE: 48
53
TITLE: Toward an Understanding of the Aqueous Solubility of Amino Acids in the Presence of Salts: A Molecular Dynamics Simulation Study
AUTHORS: Luciana I N Tome ; Miguel Jorge; Jose R B Gomes ; Joao A P Coutinho ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 114, ISSUE: 49
AUTHORS: Luciana I N Tome ; Miguel Jorge; Jose R B Gomes ; Joao A P Coutinho ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 114, ISSUE: 49
INDEXED IN: Scopus WOS
54
TITLE: Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces: 2. Density Profiles
AUTHORS: Miguel Jorge; Gyoergy Hantal; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 43
AUTHORS: Miguel Jorge; Gyoergy Hantal; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 43
55
TITLE: Molecular simulation of absolute hydration Gibbs energies of polar compounds Full Text
AUTHORS: Garrido, NM; Queimada, AJ; Jorge, M; Economou, IG; Macedo, EA ;
PUBLISHED: 2010, SOURCE: 8th Ibero-American Conference on Phase Equilibria and Fluid Properties for Process Design in FLUID PHASE EQUILIBRIA, VOLUME: 296, ISSUE: 2
AUTHORS: Garrido, NM; Queimada, AJ; Jorge, M; Economou, IG; Macedo, EA ;
PUBLISHED: 2010, SOURCE: 8th Ibero-American Conference on Phase Equilibria and Fluid Properties for Process Design in FLUID PHASE EQUILIBRIA, VOLUME: 296, ISSUE: 2
56
TITLE: A Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces. 1. Surface Site Distributions
AUTHORS: Miguel Jorge; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 25
AUTHORS: Miguel Jorge; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 25
57
TITLE: Diffusion of propane, propylene and isobutane in 13X zeolite by molecular dynamics Full Text
AUTHORS: Miguel A Granato ; Miguel Jorge; Thijs J H Vlugt; Alirio E Rodrigues ;
PUBLISHED: 2010, SOURCE: CHEMICAL ENGINEERING SCIENCE, VOLUME: 65, ISSUE: 9
AUTHORS: Miguel A Granato ; Miguel Jorge; Thijs J H Vlugt; Alirio E Rodrigues ;
PUBLISHED: 2010, SOURCE: CHEMICAL ENGINEERING SCIENCE, VOLUME: 65, ISSUE: 9
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TITLE: Structure of cationic surfactant micelles from molecular simulations of self-assembly Full Text
AUTHORS: Miguel Jorge;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3
AUTHORS: Miguel Jorge;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3
59
TITLE: Effect of the Integration Method on the Accuracy and Computational Efficiency of Free Energy Calculations Using Thermodynamic Integration Full Text
AUTHORS: Miguel Jorge; Nuno M Garrido; Antonio J Queimada; Ioannis G Economou; Eugenia A Macedo ;
PUBLISHED: 2010, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 6, ISSUE: 4
AUTHORS: Miguel Jorge; Nuno M Garrido; Antonio J Queimada; Ioannis G Economou; Eugenia A Macedo ;
PUBLISHED: 2010, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 6, ISSUE: 4
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TITLE: Molecular simulation of propane/propylene separation on the metal-organic framework CuBTC Full Text
AUTHORS: Miguel Jorge; Nabil Lamia; Alirio E Rodrigues ;
PUBLISHED: 2010, SOURCE: COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, VOLUME: 357, ISSUE: 1-3
AUTHORS: Miguel Jorge; Nabil Lamia; Alirio E Rodrigues ;
PUBLISHED: 2010, SOURCE: COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, VOLUME: 357, ISSUE: 1-3