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FCTUC

Química Física Molecular

Publicações

2010

- "Conformational Analysis of the Potential Anticancer Agent Ethyl Trihydroxycinnamate – A Combined Raman Spectroscopy and Ab Initio Study", J.B. Sousa, R. Calheiros, V. Rio, F. Borges and M.P.M. Marques, J.Mol.Struct. 783(1-3), 122-135 (2006). (DOI: 10.1016/j.molstruct.2005.09.0104).

- "Structural Characterisation of Agmatine at Physiological Conditions", A. Toninello, V. Battaglia, M. Salvi, R. Calheiros and M.P.M. Marques, Struct.Chem. 17, 163-175 (2006). (DOI: 10.1007/s11224-006-9025-1)

- "-Nitrostyrene Derivatives as Potential Antibacterial Agents: A Structure-Property-Activity Relationship Study", Nuno Milhazes, Rita Calheiros, M. Paula M. Marques, Jorge Garrido, M. Natália D.S. Cordeiro, Cátia Rodrigues, Sandra Quinteira, Carla Novais, Luísa Peixe and Fernanda Borges, Bioorg.&Med.Chem. 14, 4078-4088 (2006). (DOI: 10.1016/j.bmc.2006.02.006)

- "Pt(II) vs Pd(II) Polyamine Complexes as New Anticancer Drugs: A Structure-Activity Study", S.M.Fiuza, A.M. Amado, Paulo J. Oliveira, Vilma A. Sardão, L.A.E. Batista de Carvalho and M.P.M. Marques, Letters in Drug Design & Discovery 3 (3), 149-151 (2006). (DOI: 10.2174/157018006776286989)

- "Agmatine is Transported in Liver Mitochondria by a Specific Electrophoretic Mechanism", M. Salvi, V. Battaglia, M. Mancon, S. Colombatto, C. Cravanzola, R. Calheiros, M.P.M. Marques, M.A. Grillo and A. Toninello, Biochem.J. 396(2), 337-345 (2006). (DOI: 10.1042/BJ20060003)

- "Drug-Excipient Interactions in Ketoprofen – a Vibrational Spectroscopy Study", L.A.E. Batista de Carvalho, M.P.M. Marques and J. Tomkinson, Biopolymers 82(4), 420-424 (2006). (DOI: 10.1002/bip.20517)

- "Cytotoxic and COX-2 Inhibition Properties of Hydroxycinnamic Derivatives", M.P.M. Marques, F. Borges J.B. Sousa, R. Calheiros, J. Garrido, A. Gaspar, F. Antunes, C. Diniz and P. Fresco, Letters in Drug Design & Discovery 3 (5), 316-320 (2006). (DOI: 10.2174/157018006777574212)

- "New Insights on the Anticancer Properties of Dietary Polyphenols", P. Fresco, F. Borges, C. Diniz and M.P.M. Marques, Med.Res.Rev. 26(6) 747-766 (2006). (DOI: 10.1002/med.20060)

- "Transverse Acoustic Modes of Biogenic and ,-Polyamines: A Study by Inelastic Neutron Scattering and Raman Spectroscopies Coupled to DFT Calculations", Luís A.E. Batista de Carvalho, M. Paula M. Marques and John Tomkinson, J.Phys.Chem.A 110 12947-12954 (2006). (DOI: 10.1021/jp064837d)

- "Vibrational Spectroscopy Studies on Linear Polyamines", M.P.M. Marques and L.A.E. Batista de Carvalho, Biochem.Soc.Trans. 35(2) 374-380 (2007).

- "Evidence of a Local Order in Concentrated Aqueous Solutions of Salts Constituted by Ions of Different Valences. X-ray Diffraction and Raman Spectroscopy Experiments", M. Alves Marques, M.I. de Barros Marques, M.I. Cabaço, A.M. Gaspar, M.P.M. Marques, A.M. Amado and A.M. Amorim da Costa, J.Molecular Liquids 134(1-3), 142-150 (2007). (DOI: 10.1016/j.molliq.2006.12.007).

- "Phenolic Esters with Potential Anticancer Activity – The Structural Variable", N.F. Lopes Machado, R. Calheiros, S.M. Fiuza, F. Borges, A. Gaspar, J. Garrido and M.P.M. Marques, J.Molecular Modeling 13, 865-877 (2007). (DOI: 10.1007/s00894-007-0174-y)

- "Effect of the Metal Center on the Antitumour Activity of the Analogous Dinuclear Spermine Chelates (PdCl2)2(spermine) and (PtCl2)2(spermine)", A.S. Soares, S.M. Fiuza, M.J. Gonçalves, L.A.E. Batista de Carvalho, M.P.M. Marques and A.M. Urbano, Letters in Drug Design & Discovery 4(7), 460-463 (2007). (DOI: 10.2174/157018007781788516)

- "Conformational and Vibrational Study of cis-Diamminedichloroplatinum (II) – all-Electron Calculations", A.M. Amado, S. Fiuza, M.P.M. Marques and L.A.E. Batista de Carvalho, J.Chem.Phys. 127, 185104-185110 (2007). (DOI: 10.1063/1.2787528)

- "Spectroscopic and Electrochemical Studies of Cocaine-Opioid Interactions", J.M.P.J. Garrido, M.P.M. Marques, A.M.S. Silva, T.R.A: Macedo, A.M. Oliveira-Brett and F. Borges, Anal.Bioanal.Chem. 388, 11799-1808 (2007). (DOI: 10.1007/s00216-007-1375-z)

- "Electrochemical and Spectroscopic Characterisation of Amphetamine-like Drugs: Application to the Screening of 3,4-Methylenedioxymethamphetamine (MDMA) and its Synthetic Precursors", N. Milhazes, P. Martins, E. Uriarte, J. Garrido, R. Calheiros, M.P.M. Marques and F. Borges, Anal.Chim.Acta 596, 231-241 (2007). (DOI: 10.1016/j.aca.2007.06.027)

- "Antioxidant Phenolic Esters with Potential Anticancer Activity: A Raman Spectroscopy Study", R. Calheiros, N.F.L. Machado, S.M. Fiuza, A. Gaspar, J. Garrido, N. Milhazes, F. Borges and M.P.M. Marques, J.Raman Spec. 39, 95-107 (2008). (DOI: 10.1002/jrs.1822)

- "Use of Effective Core Potential Calculations for the Conformational and Vibrational Study of Platinum(II) Anticancer Drugs – cis-Diamminedichloroplatinum (II) as a Case Study", S. Fiuza, A.M. Amado, M.P.M. Marques and L.A.E. Batista de Carvalho, J.Phys.Chem.A 112, 3253-3259 (2008). (DOI: 10.1021/jp710868p)

- "Antioxidant versus Cytotoxic Properties of Hydroxycinnamic Acid Derivatives: a New Paradigm in Phenolic Research", M. Esteves, C. Siquet, A. Gaspar, V. Rio, J.B. Sousa, S. Reis, M.P.M. Marques and F. Borges, Archiv. der Pharmazie 341, 164-173 (2008). (DOI: 10.1002/ardp.200700168)

- "Biological Activity of Antitumoural MGBG – The Structural Variable", M.P.M. Marques, F.P.S.C. Gil, R. Calheiros, V. Battaglia, A.M. Brunati, and A. Toninello, Amino Acids (Biochemistry & Molecular Biology) 34(4) 555-564 (2008). (DOI: 10.1007/s00726-007-0009-2)

- "Voltammetric and DFT Studies on Viloxazine: Analytical Application to Pharmaceuticals and Biological Fluids", E.M.P.J. Garrido, J.M.P.J. Garrido, M. Esteves, A. Santos-Silva, M.P.M. Marques and F. Borges, Electroanalysis 20(13) 1454-1462 (2008). (DOI: 10.1002/elan.200804202)

- "Structural Studies on Supramolecular Adducts of Cyclodextrins with the Complex [Ru([9]aneS3)(bpy)Cl]Cl", J. Marques, L. Anjo, M.P.M. Marques, T.M. Santos, F.A.A. Paz and S.S. Braga, J.Organomet.Chem. 693(18) 3021-3028 (2008) (DOI: 10.1016/j.jorganchem.2008.06.023)

- "Complex Formation Between Heptakis(2,6-di-O-methyl)--cyclodextrin and Cyclopentadienyl Molybdenum(II) Dicarbonyl complexes: Structural Studies and Cytotoxicity Evaluations", C.C.L. Pereira, C.V. Diogo, A. Burgeiro, P.J. Oliveira, M.P.M. Marques, S.S. Braga, F.A.A. Paz, M. Pillinger and I.S. Gonçalves, Organometallics 27, 4948-4956 (2008). (DOI: 10.1021/om800413w)

- "Mitochondria as a Target for Novel Chemotherapeutic Agents based on Phenolic Acids", T.L. Serafim, M.P.M. Marques, F. Borges and Paulo J. Oliveira, Journal of Theoretical and Experimental Pharmacology 1, 3-13 (2008). (ISSN 1916-6958)

- "Antioxidant Phenolic Esters with Potential Anticancer Activity: Solution Equilibria Studied by Raman Spectroscopy", N.F.L. Machado, R. Calheiros, A. Gaspar, J. Garrido, F. Borges and M.P.M. Marques, J.Raman Spec. 40, 80-85 (2009). (DOI: 10.1002/jrs.2083)

- "Analytical Approaches Towards Successful Human Cell Metabolome Studies by NMR Spectroscopy", I.F. Duarte, J. Marques, A.F. Ladeirinha, C. Rocha, I. Lamego, R. Calheiros, T.M. Silva, M.P.M. Marques, J.B. Melo, I.M. Carreira and A.M. Gil, Anal.Chem. 81, 5023-5032 (2009). (DOI: 10.1021/ac900545q)

- "Conformational Behaviour of Biologically Active Ferulic Acid Derivatives", R. Calheiros, F. Borges and M.P.M. Marques, J.Molec.Struct.(THEOCHEM) 913, 146-156 (2009). (DOI: 10.1016/j.theochem.2009.07.032)

- "Fluoxetine and Norfluoxetine Revisited: New Insights into the Electrochemical and Spectroscopic Properties", E.M. Garrido, J. Garrido, R. Calheiros, M.P.M. Marques and F. Borges, J.Phys.Chem.A 113, 9934-9944 (2009). (DOI: 10.1021/jp904306b)

- "A Glycine Ruthenium Trithiacyclononane Complex and its Molecular Encapsulation using Cyclodextrins", J.T. Marques, A.M. Gil, T.M. Santos, M.P.M. Marques and S.S. Braga, Dalton Trans. 9812-9819 (2009). (DOI: 10.1039/b915839a)

- "The Anticancer Properties of Dietary Polyphenols and its Relation with Apoptosis", P. Fresco, F. Borges, M.P.M. Marques and C. Diniz, Curr.Pharm.Design 16(1), 114-134 (2010). IF=4.399 (PMID: 20214622; DOI: 10.2174/138161210789941856)

- "DNA Interaction with Palladium Chelates of Biogenic Polyamines Using Atomic Force Microscopy and Voltammetric Characterization", O. Corduneanu, A.M. Chiorcea-Paquim, V. Diculescu, S.M. Fiuza, M.P.M. Marques and A.M. Oliveira-Brett, Anal.Chem. 82, 1245-1252 (2010). (DOI: 10.1021/ac902127d)

- "Polynuclear Palladium Complexes with Biogenic Polyamines: AFM and Voltammetric Characterization", O. Corduneanu, A.M. Chiorcea-Paquim, S.M. Fiuza, M.P.M. Marques and A.M. Oliveira-Brett, Bioelectrochem. 78, 97-105 (2010). (DOI: 10.1016/j.bioelechem.2009.08.003)

- "Bioactive Chromone Derivatives – Structural Diversity", N.F.L. Machado and M.P.M. Marques, Current Bioactive Compounds 6(2), 76-89 (2010).

- "Characterization of Pt-,Pd-Spermine Complexes for their Effect on Polyamine Pathway and Cisplatin Resistance in A2780 Ovarian Carcinoma Cells", R. Tummala, P. Diegelman, S.M. Fiuza, L.A.E. Batista de Carvalho, M.P.M. Marques, D.L. Kramer, K. Clark, S. Vujcic, C.W. Porter and L. Pendyala, Oncol.Rep. 24, 15-24 (2010). (DOI: 10.3892/or_00000823)

- "Helianthus tuberosus and Polyamine Research: Past and Recent Applications of a Classical Growth Model", A. Tassoni, N. Bagni, M. Ferri, M. Franceschetti, A. Khomutov M.P.M. Marques, S.M. Fiuza, A.R. Simonian and D. Serafini-Fracassini, Plant Physiology and Biochemistry 48, 496-505 (2010). (DOI: 10.1016/j.plaphy.2010.01.019)

- "Solid State Electrochemical Behaviour of Usnic Acid at a Glassy Carbon Electrode", S.M.Alves Jorge, A.D.R. Pontinha, M.P.M. Marques and A.M. Oliveira-Brett, Anal.Lett. 43, 1713-1722 (2010). (DOI: 10.1080/00032711003653890)

- "Lithocholic Acid Derivative as a Model for Artificial Receptors. A Raman Study", F.M.F. Roleira, E.J. Tavares da Silva, R.A. Carvalho and M.P.M. Marques, Letters in Drug Design & Discovery 7(8), 610-617 (2010).

- "Conformational and Vibrational Study of cis-Diamminedichloropalladium(II)", S.M. Fiuza, A.M. Amado, H.F. dos Santos, M.P.M. Marques and L.A.E. Batista de Carvalho, Phys.Chem.Chem.Phys. in press.

- "Characterisation of Antioxidant Olive Oil Biophenols by Vibrational Spectroscopy and Theoretical Calculations", F. Paiva-Martins, V. Rodrigues, R. Calheiros and M.P.M. Marques, J.Sci.Food Agric. in press.

- "A Nuclear Magnetic Resonance (NMR) Study of the Effect of Cisplatin on the Metabolic Profile of MG-63 Osteosarcoma Cells", I.F. Duarte, I. Lamego, J. Marques, M.P.M. Marques, B.J. Blaise and Ana M. Gil, J.Proteome Research in press.

- "Chromone-3-Carboxylic Acid as a Potential Electron Scavenger: A Surface-Enhanced Raman Scattering Study", N.F.L. Machado, C. Ruano, J.L. Castro, M.P.M. Marques and J.C. Otero, Phys.Chem.Chem.Phys. in press.

2009


Publications in peer review Journals

1. “Fluoxetine and Norfluoxetine Revisited: New Insights into the Electrochemical and Spectroscopic Properties”, E.M. Garrido, J. Garrido, R. Calheiros, M.P.M. Marques and F. Borges, J.Phys.Chem.A 113, 9934-9944 (2009). DOI: 10.1021/jp904306b.

2. “Conformational Behaviour of Biologically Active Ferulic Acid Derivatives”, R. Calheiros, F. Borges and M.P.M. Marques, J.Molec.Struct.(THEOCHEM) 913, 146-156 (2009). DOI: 10.1016/j.theochem.2009.07.032.

3. “Antioxidant Phenolic Esters with Potential Anticancer Activity: Solution Equilibria Studied by Raman Spectroscopy”, N.F.L. Machado, R. Calheiros, A. Gaspar, J. Garrido, F. Borges and M.P.M. Marques, J. Raman Spectrosc. 40, 80-85 (2009). DOI: 10.1002/jrs.2083.

4. “Effect of Hydrogen Bonding in the Vibrational Spectra of trans-Cinnamic Acid”

M.M. Nolasco, A.M. Amado and P.J.A. Ribeiro-Claro

J. Raman Spectrosc. 40, 394-400 (2009). DOI: 10.1002/jrs.2138.

5. “Spectroscopic and thermal studies on the inclusion of trans-cinnamic acid and a number of its hydroxyl derivatives with a, b and g-cyclodextrins molecules”. M.M. Nolasco, A.M. Amado and P.J.A. Ribeiro-Claro, J. Raman Spectrosc. 40, 687-695 (2009). Doi: 10.1002/jrs.2182.

6. “Inclusion compounds of phenol derivatives with cyclodextrins: a combined spectroscopic and thermal analysis” M. Sardo, A.M. Amado and P.J.A. Ribeiro-Claro, J. Raman Spectrosc. 40, 1624-1633 (2009). Doi: 10.1002/jrs.2310.

7. “Hydrogen bonding in nitrofurantoin polymorphs: a computation-assisted spectroscopic study”, M. Sardo, A.M. Amado and P.J.A. Ribeiro-Claro, J. Raman Spectrosc. 40, 1956 – 1965 (2009). Doi: 10.1002/jrs.2346.

8. “A comparative analysis of phytococolloids produced by underutilized versus industrially utilized carrageenophytes (Gigartinales, Rhodophyta).

L. Pereira, A.T. Critchley, A.M. Amado and P.J.A. Ribeiro-Claro, J. Appl. Phytcol. 21, 599-605 (2009). Doi: 10.1007/s10811-009-9447-4.

9. “Identification of Selected Seaweed Polysaccharides (polycocolloids) by Vibrational Spectroscopy (FTIR-ATR and FT-Raman)”. L. Pereira, A.M. Amado, A.T. Critchley, F. Van de Velde and P.J.A. Ribeiro-Claro, Food Hydrocolloids 23, 1903-1909(2009). Doi: 10.1016/j.foodhyd.2008.11.014.

10. “Mean distance of closest approach of potassium, cesium and rubidium ions in aqueous solutions: Experimental and theoretical calculations”.A.C.F. Ribeiro, V.M.M. Lobo, H.D. Burrows, A.J.M. Valente, A.J.F.N. Sobral, A.M. Amado, C.I.A.V. Santos e M.A. Esteso, J. Mol. Liq. 146, 69-73 (2009). Doi: 10.1016/j.molliq.2009.02.006.

- “Human bronchial epithelial cells malignantly transformed by hexavalent chromium exhibit an aneuploid phenotype but no microsatellite instability “, C.F.D. Rodrigues, A.M. Urbano, E. Matoso, I. Carreira, A. Almeida, P. Santos, F. Botelho, L. Carvalho, M. Alves, C. Monteiro, A.N. Costa, V. Moreno and M.C. Alpoim, Mutat. Res. – Fundam. Mol. Mech. Mutagen. 670, 42-52 (2009). DOI: 10.1016/j.mrfmmm.2009.07.004.

- “Analytical Approaches Towards Successful Human Cell Metabolome Studies by NMR Spectroscopy”, I.F. Duarte, J. Marques, A.F. Ladeirinha, C. Rocha, I. Lamego, R. Calheiros, T.M. Silva, M.P.M. Marques, J.B. Melo, I.M. Carreira and A.M. Gil, Anal.Chem. 81, 5023-5032 (2009). DOI: 10.1021/ac900545q.

- “A Glycine Ruthenium Trithiacyclononane Complex and its Molecular Encapsulation using Cyclodextrins”, J.T. Marques, A.M. Gil, T.M. Santos, M.P.M. Marques and S.S. Braga, Dalton Trans. 9812-9819 (2009). DOI: 10.1039/b915839a.


Chapters in books:

1.“Raman Microspectroscopy: Applications in Life Sciences”, M.P.M. Marques and L.A.E. Batista de Carvalho, in "Image Analysis in Life Sciences”, Carmen Diniz (Ed.), Research Signpost, 2009. ISBN 978-81-308-0312-8

2. “Food Products that Help to Promote Human Health”, A. Moreira da Silva in “Food, diet and health: past, present and future tendencies”, Chapter 4, Nova Publishers, 2009. ISBN: 978-1-60876-012-1.