CQC - Coimbra Chemistry Centre

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Organization name
CQC - Coimbra Chemistry Centre
Director
Parent OrgUnit
City
Coimbra
Country
Portugal

OrgUnit's Researchers publications
(Publicação Unidade orgânica/Workgroup)

Resultados 741-760 de 1386.

Data de publicaçãoTítuloAutor(es)TipoAcesso
7412012Molecular dynamics simulation of HIV fusion inhibitor T-1249: insights on peptide-lipid interactionCanto, A. M. T. Martins do; Carvalho, A. J. Palace; Ramalho, J. P. Prates; Loura, Luís M. S. articleopenAccess
74224-Mar-2022Molecular Dynamics Simulations: Advances and ApplicationsFilipe, Hugo A. L. ; Loura, Luís M. S. articleopenAccess
74318-Mai-2016Molecular Dynamics Study of Self-Assembly of Aqueous Solutions of Poly[9,9-bis(4-Sulfonylbutoxyphenylphenyl) Fluorene-2,7-diyl-2,2'-Bithiophene] (PBS-PF2T) in the Presence of Pentaethylene Glycol Monododecyl Ether (C12E₅)Stewart, Beverly ; Burrows, Hugh Douglas articleopenAccess
7442012Molecular etiology of atherogenesis--in vitro induction of lipidosis in macrophages with a new LDL modelEstronca, Luís ; Silva, Joao Carlos Pinho; Sampaio, Julio L.; Shevchenko, Andrej; Verkade, Paul; Vaz, Alfin D. N.; Vaz, Winchil L. C. ; Vieira, Otília V. articleopenAccess
7451-Nov-2013Molecular insight into the amine–water interaction: a combined vibrational, energetic and NBO/NEDA studyJesus, A. J. Lopes ; Redinha, J. S. articleopenAccess
6461990A molecular mechanics force field for conformational analysis of aliphatic acyclic aminesCarvalho, L. A. E. Batista de ; Teixeira-Dias, J. J. C. ; Fausto, R. articleopenAccess
647Mai-1986A Molecular Mechanics Force Field for Conformational Analysis of Simple Acylchlorides, Carboxylic and EstersTeixeira-Dias, J. J. C. ; Fausto, Rui articleopenAccess
6482010Molecular modeling of the interaction of novel hydroxy- and aminobisphosphonates with hydroxyapatiteDuarte, Luís F. ; Teixeira, Fátima C. ; Fausto, Rui articleopenAccess
6492009Molecular modeling of the interaction of novel hydroxy- and aminobisphosphonates with hydroxyapatiteDuarte, Luís F. ; Teixeira, Fátima C. ; Fausto, Rui articleopenAccess
650Out-2001Molecular modelling and 1H-NMR: ultimate tools for the investigation of tolbutamide: beta-cyclodextrin and tolbutamide: hydroxypropyl-beta-cyclodextrin complexesVeiga, Francisco José Baptista ; Fernandes, Catarina Marques ; Carvalho, Rui Albuquerque ; Geraldes, Carlos Frederico Gusmão Campos articleopenAccess
6511999A molecular orbital study on the conformational properties of dopamine [1,2-benzenediol-4(2-aminoethyl)]and dopamine cationFausto, Rui ; Ribeiro, Maria João S. ; Lima, João J. Pedroso de articleopenAccess
6521-Dez-1997Molecular structure and charge density analysis of p-methoxybenzoic acid (anisic acid)Fausto, R. ; Matos-Beja, A. ; Paixão, J. A. articleopenAccess
65315-Jul-2002Molecular structure and infrared spectra of dimethyl fumarateLopes, Susy ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
65414-Nov-2002Molecular structure and infrared spectra of dimethyl malonate: A combined quantum chemical and matrix-isolation spectroscopic studyLopes, Susy ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
6552002Molecular structure and infrared spectra of dimethyl oxalateLopes, Susy Branco ; Lapinski, Leszek ; Fausto, Rui articleopenAccess
656Mar-2008Molecular structure and infrared spectra of the monomeric 3-(methoxy)-1,2-benzisothiazole 1,1-dioxide (methyl pseudosaccharyl ether)Kaczor, Agnieszka ; Almeida, Rui ; Gómez-Zavaglia, Andrea ; Cristiano, Maria de Lurdes S. ; Fausto, Rui articleopenAccess
657Out-2014Molecular structure and polymorphism of a cyclohexanediol: trans-1,4-cyclohexanedimethanolRosado, Mário T. S. ; Maria, Teresa M. R. ; Castro, Ricardo A. E. ; Canotilho, João ; Silva, Manuela Ramos ; Eusébio, M. Ermelinda S. articleopenAccess
6581-Set-2008Molecular structure and vibrational spectra of 2(5H)-furanone and 2(5H)-thiophenone isolated in low temperature inert matrixBreda, S. ; Reva, I. ; Fausto, R. articleopenAccess
6591998Molecular structure and vibrational spectra of methyl cyanoacetate: an FT-IR, raman and ab initio molecular orbital studyNeta, João Miguel F. ; Fausto, Rui articleopenAccess
660Out-1999Molecular structure and vibrational spectra of methyl glycolate and methyl α-hydroxy isobutyrateJarmelo, S. ; Fausto, R. articleopenAccess