João Paulo Cristóvão Almeida Prates Ramalho. É Professor Associado na Universidade de Évora. Publicou 61 artigos em revistas especializadas, possui 2 capítulos de livros publicados. Actua na área de Química Nas suas actividades profissionais interagiu com 130 colaboradores em co-autorias de trabalhos científicos.
Endereço de acesso a este CV: http://www.degois.pt/visualizador/curriculum.jsp?key=3586723414163883

Nome completo Full name	João Paulo Cristóvão Almeida Prates Ramalho
Nome em citações bibliográficas Quoting name	J. P. Prates Ramalho
Categoria profissional Position	Professor Associado
Domínio científico de atuação Scientific domain	Ciências Exactas-Química. Ciências Exactas-Outras Ciências Exactas.

Endereço profissional Professional address

Universidade de Évora Escola de Ciências e Tecnologia Departamento de Química Colégio Luís Verney, Rua Romão Ramalho 59 7000 Évora Portugal Correio electrónico: jpcar@uevora.pt

Sexo Gender

Masculino»Male

1995	Doutoramento Phd
Doutoramento em Química. Universidade de Lisboa, Portugal.

1987	Licenciatura Licentiate degree
Licenciatura em Química (4 anos » years) . Universidade de Lisboa, Portugal.

Universidade de Évora

Jan/2005-Actual

Professor Associado

Jan/1998-2004

Professor Auxiliar

Jan/1996-1997

Assistente

Out/1994-1995

Assistente de Investigação

Universidade do Porto

Set/1992-1994

Assistente Estagiário

Compreende Understandig	Inglês (Bem), Francês (Razoavelmente), Espanhol (Bem), Romeno (Bem).
Fala Speaking	Inglês (Bem), Francês (Pouco), Espanhol (Bem), Romeno (Bem).
Lê Reading	Inglês (Bem), Francês (Razoavelmente), Espanhol (Bem), Romeno (Bem).
Escreve Writing	Inglês (Bem), Francês (Pouco), Espanhol (Razoavelmente), Romeno (Pouco).

Actual

Sociedade Portuguesa de Química, Membro.

Capítulos de livros publicados Published book chapters

1.	M.S., Lus; Palace, A.J.; Prates, J.P.. 2012. Recent Developments in the Study of the Behavior of Fluorescent Membrane Probes in Lipid Bilayers: Molecular Dynamics Approach.  In Biophysics, ed. Prof. Dr. A.N. Misra, 133 - 154. ISBN: 978-953-51-0376-9. Rijeka, Croatia: InTech.

2.	Ramalho, J. P. P; Pacheco, J. M. 1998. Towards a first-principles determination of the phase diagram of C-60 .  In CONDENSED MATTER THEORIES, ed. da Providencia, J; Malik, FB, 343 - 354. ISBN: 1-56072-602-4. New York: NOVA SCIENCE PUBLISHERS.

Artigos em revistas com arbitragem científica Papers in periodics with scientific refereeing

1.	Vinteler, Emil; Stan, Nicoleta-Florina; Luchian, Raluca; Cainap, Calin; Ramalho, João P. P; Chis, Vasile. 2015. "Conformational landscape and low lying excited states of imatinib", Journal of Molecular Modeling 21, 4: 1 - 13.

2.	Carvalho, A. J. P; Dordio, A. V; Ramalho, J. P. P. 2014. "A DFT study on the adsorption of benzodiazepines to vermiculite surfaces", Journal of Molecular Modeling 20, 7: 1 - 8.

3.	Ungurean, Alia; Oltean, Mircea; David, Leontin; Leopold, Nicolae; Prates Ramalho, J. P; Chis, Vasile. 2014. "Adsorption of sulfamethoxazole molecule on silver colloids: A joint SERS and DFT study", Journal of Molecular Structure 1073, 1: 71 - 76.

4.	Silva, Tiago J. L; Mendes, Paulo J; Santos, Ana M; Garcia, M. H; Robalo, M. P; Ramalho, J. P. P; Carvalho, A. J. P; Büchert, Marina; Wittenburg, Christian; Heck, Jürgen. 2014. " Mono(¿ 5 -cyclopentadienyl)metal(II) Complexes with Thienyl Acetylide Chromophores: Synthesis, Electrochemical Studies, and First Hyperpolarizabilities ", Organometallics 33, 18: 4655 - 4671.

5.	Robalo, João R; do Canto, A. M. T. M; Carvalho, A. J. P; Ramalho, J. P. P; Loura, Luís M. S. 2013. "Behavior of Fluorescent Cholesterol Analogues Dehydroergosterol and Cholestatrienol in Lipid Bilayers: A Molecular Dynamics Study", The Journal of Physical Chemistry B 117, 19: 5806 - 5819.

6.	Ramalho, João P. P; Gomes, José R. B; Illas, Francesc. 2013. "Accounting for van der Waals interactions between adsorbates and surfaces in density functional theory based calculations: selected examples", RSC Advances 3, 32: 13085 - 13085.

7.	Avó, João; Martins, Sérgio; Parola, A. J; Lima, João C; Branco, Paula S; Prates Ramalho, J. P; Pereira, António. 2013. "A Family of Styrylcoumarins: Synthesis, Spectroscopic, Photophysical and Photochemical Properties", ChemPlusChem 78, 8: 789 - 792.

8.	Prates Ramalho, J. P; Dordio, Ana V; Palace Carvalho, A. J. 2013. "Adsorption of two phenoxyacid compounds on a clay surface: a theoretical study", Adsorption, 19: 937 - 944.

9.	Silva, Tiago J. L; Mendes, Paulo J; Garcia, M. H; Robalo, M. P; Prates Ramalho, J. P; Palace Carvalho, A. J; Büchert, Marina; Wittenburg, Christian; Heck, Jürgen. 2013. "Benzo[c]thiophene Chromophores Linked to Cationic Fe and Ru Derivatives for NLO Materials: Synthesis Characterization and Quadratic Hyperpolarizabilities ", European Journal of Inorganic Chemistry 2013, 20: 3506 - 3517.

10.	Robalo, João R; Ramalho, J. P. P; Loura, Luís M. S. 2013. "NBD-Labeled Cholesterol Analogues in Phospholipid Bilayers: Insights from Molecular Dynamics", The Journal of Physical Chemistry B 117, 44: 13731 - 13742.

11.	Martins do C. A; Carvalho, Alfredo; Ramalho, João; Loura, Luís. 2013. "Effect of Amphipathic HIV Fusion Inhibitor Peptides on POPC and POPC/Cholesterol Membrane Properties: A Molecular Simulation Study", International Journal of Molecular Sciences 14, 7: 14724 - 14743.

12.	Martins do C. A. M. T; Palace Carvalho, A. J; Prates Ramalho, J. P; Loura, Luís M. S. 2012. "Molecular Dynamics Simulation of HIV Fusion Inhibitor T-1249: Insights on Peptide-Lipid Interaction", Computational and Mathematical Methods in Medicine 2012, 151854: 1 - 14.

13.	Prates Ramalho, J; Illas, Francesc. 2012. "Assessing the importance of Van der Waals interactions on the adsorption of azobenzene on the rutile TiO2(110) surface", Chemical Physics Letters 545, 1: 60 - 65.

14.	Mendes, Paulo J; Silva, Tiago J. L; Garcia, M. H; Ramalho, J. P. P; Carvalho, A. J. P. 2012. " Switchable Nonlinear Optical Properties of ¿ 5 -Monocyclopentadienylmetal Complexes: A DFT Approach ", Journal of Chemical Information and Modeling 52, 8: 1970 - 1983.

15.	Prates Ramalho, J. P; Illas, Francesc. 2011. "Theoretical study of the adsorption and dissociation of azobenzene on the rutile TiO2(110) surface", Chemical Physics Letters, 1: 1 - 10.

16.	Prates Ramalho, J. P; Gkeka, Paraschiva; Sarkisov, Lev. 2011. "Structure and Phase Transformations of DPPC Lipid Bilayers in thePresence of Nanoparticles: Insights from Coarse-Grained Molecular Dynamics Simulations", Langmuir, 1: 1 - 10.

17.	Prates Ramalho, J. P; Marinho, Vanda; Rodrigues, Ana I; Burke, Anthony. 2011. "Evaluation of Phosphinoamidoester-Derived Pd Catalysts in the Asymmetric Allylic Alkylation Reaction: Theoretical Studies and Mechanistic Insights", CHIRALITY 23, 5: 383 - 388.

18.	Prates Ramalho, J. P; Carreiro, Elisabete; Burke, Anthony. 2011. "Chiral monooxazolines as modular copper(I)-heterocomplex building blocks: investigations on the catalytic asymmetric cyclopropanation of alkenes", Tetrahedron 67, 25: 4640 - 4648.

19.	Prates Ramalho, J. P; Loura, Luis. 2011. "Recent Developments in Molecular Dynamics Simulations of Fluorescent Membrane Probes", Molecules 16, 7: 5437 - 5452.

20.	Prates Ramalho, J. P; Martins, Luis F; Palace, Alfredo J; Filipe, Eduardo. 2011. "Excess Thermodynamic Properties of Mixtures Involving Xenon and Light Alkanes: A Study of Their Temperature Dependence by Computer Simulation", The Journal of Physical Chemistry B , 1: 1 - 10.

21.	Prates Ramalho, J. P; Martins do C. A; Palace Carvalho, A; Loura, Luís. 2011. "Molecular dynamics simulations of T-20 HIV fusion inhibitor interacting with model membranes", BIOPHYSICAL CHEMISTRY 159, 2-3: 275 - 286.

22.	Carvalho, A.J. P; Ramalho, J.P. P. 2010. "Molecular simulation of C60 adsorption onto a TiO2 rutile (110) surface", Applied Surface Science 256, 17: 5365 - 5369.

23.	Loura, Luís M; Carvalho, A.J. P; Ramalho, J.P. P. 2010. "Direct calculation of Förster orientation factor of membrane probes by molecular simulation", Journal of Molecular Structure: THEOCHEM 946, 1-3: 107 - 112.

24.	Martins do C. A; Palace Carvalho, A; Prates Ramalho, J; Loura, Luís M. 2010. "Structure and conformation of HIV fusion inhibitor peptide T-1249 in presence of model membranes: A molecular dynamics study", Journal of Molecular Structure: THEOCHEM 946, 1-3: 119 - 124.

25.	Mendes, Paulo J; Silva, Tiago J; Carvalho, A.J. P; Ramalho, J.P. P. 2010. "DFT studies on thiophene acetylide Ru(II) complexes for nonlinear optics: Structure–function relationships and solvent effects", Journal of Molecular Structure: THEOCHEM 946, 1-3: 33 - 42.

26.	Marinho, Vanda R; Ramalho, J. P. P; Rodrigues, Ana I; Burke, Anthony J. 2010. " A Comparison of ( R , R )-Me-DUPHOS and ( R , R )-DUPHOS- i Pr Ligands in the Pd 0 -Catalysed Asymmetric Allylic Alkylation Reaction: Stereochemical and Kinetic Considerations ", European Journal of Organic Chemistry 2010, 8: 1593 - 1593.

27.	Gomes, J.R.B.; Ramalho, J.P. P; Illas, F.. 2010. "Adsorption of Xe atoms on the TiO2(110) surface: A density functional study", Surface Science 604, 3-4: 428 - 434.

28.	Marinho, Vanda R; Ramalho, J. P. P; Rodrigues, Ana I; Burke, Anthony J. 2009. " A Comparison of ( R , R )-Me-DUPHOS and ( R , R )-DUPHOS- i Pr Ligands in the Pd 0 -Catalysed Asymmetric Allylic Alkylation Reaction: Stereochemical and Kinetic Considerations ", European Journal of Organic Chemistry 2009, 36: 6311 - 6317.

29.	Marques, Carolina S; Ramalho, J. P. P; Burke, Anthony J. 2009. "The benzilic ester rearrangement: synthesis of labelled compounds and theoretical studies", Journal of Physical Organic Chemistry 22, 8: 735 - 739.

30.	Carreiro, Elisabete P; Burke, Anthony J; Ramalho, J.P. P; Rodrigues, Ana I. 2009. "Arylid-OX and Arylid-BOX derived catalysts: applications in catalytic asymmetric cyclopropanation", Tetrahedron: Asymmetry 20, 11: 1272 - 1278.

31.	Mendes, Paulo J; Carvalho, A.J. P; Ramalho, J.P. P. 2009. "Role played by the organometallic fragment on the first hyperpolarizability of iron–acetylide complexes: A TD-DFT study", Journal of Molecular Structure: THEOCHEM 900, 1-3: 110 - 117.

32.	Loura, Luís M. S; Prates Ramalho, J. P. 2009. "Fluorescent membrane probes’ behavior in lipid bilayers: insights from molecular dynamics simulations", Biophysical Reviews 1, 3: 141 - 148.

33.	Martins Do C. A. M. T; Palace Carvalho, A. J; Prates Ramalho, J. P; Loura, Luís M. S. 2008. "T-20 and T-1249 HIV fusion inhibitors' structure and conformation in solution: a molecular dynamics study", Journal of Peptide Science 14, 4: 442 - 447.

34.	Loura, Luís M; Fernandes, Fábio; Fernandes, A.C.; Ramalho, J.P. P. 2008. "Effects of fluorescent probe NBD-PC on the structure, dynamics and phase transition of DPPC. A molecular dynamics and differential scanning calorimetry study", Biochimica et Biophysica Acta (BBA) - Biomembranes 1778, 2: 491 - 501.

35.	Burke, Anthony J; Palma Carreiro, E.; Chercheja, Serghei; Moura, Nuno M; Prates Ramalho, J; Rodrigues, Ana I; dos Santos, C. I. 2007. "Cu(I) catalysed cyclopropanation of olefins: Stereoselectivity studies with Arylid-Box and Isbut-Box ligands", Journal of Organometallic Chemistry 692, 22: 4863 - 4874.

36.	Rakhmatkariev, G. U; Palace Carvalho, A. J; Prates Ramalho, J. P. 2007. "Adsorption of Normal Pentane on the Surface of Rutile. Experimental Results and Simulations", Langmuir 23, 14: 7555 - 7561.

37.	Carvalho, A. J. P; Ramalho, J. P. P; Martins, Luís F. G. 2007. "Excess Thermodynamics of Mixtures Involving Xenon and Light Linear Alkanes by Computer Simulation", The Journal of Physical Chemistry B 111, 23: 6437 - 6443.

38.	CARVALHO, A; RAMALHO, J; VILLIERAS, F. 2007. "Simulation study of argon adsorption on (001) faces of phyllosilicates", Applied Surface Science 253, 13: 5628 - 5632.

39.	LOURA, L; RAMALHO, J. 2007. "Location and dynamics of acyl chain NBD-labeled phosphatidylcholine (NBD-PC) in DPPC bilayers. A molecular dynamics and time-resolved fluorescence anisotropy study", Biochimica et Biophysica Acta (BBA) - Biomembranes 1768, 3: 467 - 478.

40.	Ramalho, J. P. P; Carvalho, A. J. P. 2007. "Experimental and simulation study of n-heptane adsorption on rutile", ADSORPTION SCIENCE & TECHNOLOGY  25, 7: 517 - 530.

41.	RAMALHO, J; RABINOVICH, A; YEREMICH, D; TOVBIN, Y. 2005. "Surface topography problem and argon adsorption on crystalline faces: Monte-Carlo and lattice-gas model simulations", Applied Surface Science 252, 3: 529 - 537.

42.	Mendes, P.J.; Ramalho, J.P. P; Candeias, A.J.E.; Robalo, M.P.; Garcia, M.H.. 2005. "Density functional theory calculations on ¿5-monocyclopentadienylnitrilecobalt complexes concerning their second-order nonlinear optical properties", Journal of Molecular Structure: THEOCHEM 729, 1-2: 109 - 113.

43.	Palace Carvalho, A; Ferreira, T.; Estêvão Candeias, A; Prates Ramalho, J. 2005. "Molecular simulations of nitrogen adsorption in pure silica MCM-41 materials", Journal of Molecular Structure: THEOCHEM 729, 1-2: 65 - 69.

44.	da Plama C. E; Chercheja, Serghei; Burke, Anthony J; Ramalho, J.P. P; Rodrigues, Ana I. 2005. "Isbut-Box: A new chiral C2 symmetric bis-oxazoline for catalytic enantioselective synthesis", Journal of Molecular Catalysis A: Chemical 236, 1-2: 38 - 45.

45.	Gomes, J.; Prates Ramalho, J. 2005. "Adsorption of Ar atoms on the relaxed defect-free TiO2(110) surface", Physical Review B 71, 23: 1 - 2.

46.	Mudring, Anja-Verena; Jansen, Martin; Daniels, Jörg; Krämer, Steffen; Mehring, Michael; Prates Ramalho, J. P; Romero, Aldo H; Parrinello, Michele. 2002. "Cesiumauride Ammonia (1/1), CsAu·NH3: A Crystalline Analogue to Alkali Metals Dissolved in Ammonia?", Angewandte Chemie International Edition 41, 1: 120 - 124.

47.	Bushenkov, Vladimir A; Ramalho, J. P. P; Smirnov, Georgi V. 2001. "Adsorption integral equation via complex approximation with constraints: kernel of general form", Journal of Computational Chemistry 22, 10: 1058 - 1066.

48.	Bushenkov, Vladimir A; Ramalho, J. P. P; Smirnov, Georgi V. 2000. "Adsorption integral equation via complex approximation with constraints: The Langmuir kernel", Journal of Computational Chemistry 21, 3: 191 - 191.

49.	Ramalho, J. P. P; Smirnov, G. V. 2000. "On the structure of a local isotherm and solution to the adsorption integral equation", LANGMUIR 16, 4: 1918 - 1923.

50.	Ramalho, J. P. P; Ferreira, A. L. C. 2000. "Phase diagram of C-60 from ab initio intermolecular potential", JOURNAL OF CHEMICAL PHYSICS 113, 2: 738 - 743.

51.	Pacheco, J.; Prates Ramalho, J. 1997. "First-Principles Determination of the Dispersion Interaction between Fullerenes and Their Intermolecular Potential", Physical Review Letters 79, 20: 3873 - 3876.

52.	Carrott, P; Prates Ramalho, J. P. 1997. "Influence of surface ionization on the adsorption of aqueous zinc species by activated carbons", Carbon 35, 3: 403 - 410.

53.	Fernandes, F. M. S. S; Ramalho, J. P. P; Freitas, F. F. M. 1996. "High dimensional geometry in statistical mechanics. A new microcanonical sampling method", Pure and Applied Chemistry 68, 8: 1509 - 1514.

54.	Fernandes, Pedro A; Carvalho, Alfredo P; Ramalho, J. P. P. 1995. "Path integral Monte Carlo simulations: Study of the efficiency of energy estimators", The Journal of Chemical Physics 103, 13: 5720 - 5720.

55.	Fernandes, Fernando M; Ramalho, J.P.Prates. 1995. "Hypervolumes in microcanonical Monte Carlo", Computer Physics Communications 90, 1: 73 - 80.

56.	Carrott, P. J. M; Carrott, M. M. L. R; Candeias, A. J. E; Ramalho, J. P. P. 1995. "Numerical simulation of surface ionisation and specific adsorption on a two-site model of a carbon surface", Journal of the Chemical Society, Faraday Transactions 91, 14: 2179 - 2179.

57.	Ramalho, J. 1994. "Light metal ions in water: Quantal and classical simulations for 7Li+", Journal of Molecular Liquids 60, 1-3: 237 - 249.

58.	Ramalho, J. P. P; Cabral, B. J. C; Fernandes, F. M. S. S. 1993. "Improved propagators for the path integral study of quantum systems", The Journal of Chemical Physics 98, 4: 3300 - 3300.

59.	Ramalho, J. P. P; Cabral, B. J. C; Fernandes, F. M. S. S. 1991. "A MONTE-CARLO AND TRANSFER-MATRIX GRID PATH-INTEGRAL STUDY OF THE VIBRATIONAL STRUCTURE OF BR2 IN SOLID ARGON", CHEMICAL PHYSICS LETTERS 184, 1-3: 53 - 60.

60.	Ramalho, J. P. P; Fernandes, F. M. S. 1990. "THE TRANSFER-MATRIX GRID METHOD FOR QUANTUM PARTITION-FUNCTIONS, EIGENVALUES AND EIGENFUNCTIONS", ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES  45, 9-10: 1193 - 1198.

Artigos em revistas sem arbitragem científica Papers in periodics without scientific refereeing

1.	Pereira, Luís A. M; Martins, Luís F. G; Ascenso, José R; Morgado, Pedro; Ramalho, João P. P; Filipe, Eduardo J. M. 2014. "Diffusion Coefficients of Fluorinated Surfactants in Water: Experimental Results and Prediction by Computer Simulation", Journal of Chemical & Engineering Data 59, 10: 3151 - 3159.

Participação no júri de Graus Académicos Academic Degrees jury participation

Participação no júri de Graus Académicos Academic Degrees jury participation

Doutoramento Phd

1.	J. P. Prates Ramalho. Participação no júri de António Manuel Teixeira Martins do Canto. Estudo teórico da estrutura e dinâmica de péptidos inibidores da fusão do HIV em água e membranas biológicas, 2013.

2.	J. P. Prates Ramalho. Participação no júri de Breno Rodrigues Lamaghere Galvão. POTENTIAL ENERGY SURFACES AND DYNAMICS OF ATMOSPHERIC REACTIONS, 2012. Tese (Química) - Universidade de Coimbra.

3.	J. P. Prates Ramalho. Participação no júri de Natércia Fernandes Brás. Optimização da Síntese Enzimática de Oligossacarídeos , 2011. Tese (Química) - Universidade do Porto.

4.	J. P. Prates Ramalho. Participação no júri de Marta Luísa Afonso de Carvalho Araújo. THE PHOTODISSOCIATION OF FORMALDEHYDE: A QUANTUM CHEMISTRY AND DIRECT QUANTUM DYNAMICS STUDY, 2011. Tese (Química) - Universidade do Porto.

5.	J. P. Prates Ramalho. Participação no júri de Alexandre Rodrigues Faria de Carvalho. Métodos Computacionais na Previsãoo de Propriedades Físico-Químicas de Sistemas Moleculares, 2011. Tese (Química) - Universidade do Porto.

6.	J. P. Prates Ramalho. Participação no júri de Elisabete da Palma Carreiro. Catalysis with Bis(Oxazoline), Mono(Oxazoline) and Diphosphine Ligand, 2010. Tese (Química) - Universidade de Évora.

7.	J. P. Prates Ramalho. Participação no júri de Pedro Celestino dos Reis Rodrigues. Transições de Fase em Sistemas Iónicos. Modelos Teóricos e Simulação Computacional, 2007. Tese (Química-Física) - Universidade de Lisboa.

8.	J. P. Prates Ramalho. Participação no júri de Maria de Fátima Assunção Lucas. Theoretical Studies on Enzymes, 2007. Tese (Quimica) - Universidade do Porto.

9.	J. P. Prates Ramalho. Participação no júri de Akapong Suwatanamala. Computational Study on Thiacalix[4]arenes Complexes, 2006. Tese (Quimica) - Universidade do Porto.

10.	J. P. Prates Ramalho. Participação no júri de Daniel José Viegas Antunes dos Santos. Estudos Teóricos da Química de Interfaces, 2003. Tese (Quimica) - Universidade do Porto.

11.	J. P. Prates Ramalho. Participação no júri de Alfredo Jorge Palace Carvalho . Estudos de Processos Electroquímicos em Solução, 2001. Tese (Química) - Universidade do Porto.

12.	J. P. Prates Ramalho. Participação no júri de Pedro Manuel Azevedo Alexandrino Fernandes. Reacções de Transferência Iónica Através da Interface Entre Líquidos Imiscíveis, 2000. Tese (Quimica) - Universidade do Porto.

Produção científica Scientific production

Dados complementares data

Total

Produção científica Scientific production

63

Livros e capítulos Books and book chapters

2

Capítulos de livros publicados Published book chapters

2

Artigos científicos em revistas Papers in periodics

61

Com arbitragem científica With scientific refereeing

60

Sem arbitragem científica Without scientific refereeing

1

Total

Dados complementares (Additional data)

12

Participação no Júri de Graus Académicos Academic Degrees jury participation

12

	Alfredo Jorge Palace Carvalho
	Ana Vitória Martins Neves Barrocas Dordio
	António Manuel Teixeira Martins do Canto
	Fábio Monteiro Fernandes
	Paulo Jorge Gomes Mendes