João P. Prates Ramalho
João P. Prates Ramalho
Associate Professor, Evora University
Η διεύθυνση ηλεκτρονικού ταχυδρομείου έχει επαληθευτεί στον τομέα uevora.pt
Τίτλος
Παρατίθεται από
Παρατίθεται από
Έτος
First-principles determination of the dispersion interaction between fullerenes and their intermolecular potential
JM Pacheco, JPP Ramalho
Physical review letters 79 (20), 3873, 1997
1321997
Accounting for van der Waals interactions between adsorbates and surfaces in density functional theory based calculations: selected examples
JPP Ramalho, JRB Gomes, F Illas
RSC Advances 3 (32), 13085-13100, 2013
1192013
Influence of surface ionization on the adsorption of aqueous zinc species by activated carbons
PJM Carrott, MMLR Carrott, JMV Nabais, JPP Ramalho
Carbon 35 (3), 403-410, 1997
921997
Structure and phase transformations of DPPC lipid bilayers in the presence of nanoparticles: insights from coarse-grained molecular dynamics simulations
JP Prates Ramalho, P Gkeka, L Sarkisov
Langmuir 27 (7), 3723-3730, 2011
882011
Location and dynamics of acyl chain NBD-labeled phosphatidylcholine (NBD-PC) in DPPC bilayers. A molecular dynamics and time-resolved fluorescence anisotropy study
LMS Loura, JPP Ramalho
Biochimica et Biophysica Acta (BBA)-Biomembranes 1768 (3), 467-478, 2007
882007
Recent developments in molecular dynamics simulations of fluorescent membrane probes
L Loura, JP Ramalho
Molecules 16 (7), 5437-5452, 2011
712011
Mechanisms of removal of three widespread pharmaceuticals by two clay materials
AV Dordio, S Miranda, JPP Ramalho, AJP Carvalho
Journal of hazardous materials 323, 575-583, 2017
602017
Effects of fluorescent probe NBD-PC on the structure, dynamics and phase transition of DPPC. A molecular dynamics and differential scanning calorimetry study
LMS Loura, F Fernandes, AC Fernandes, JPP Ramalho
Biochimica et Biophysica Acta (BBA)-Biomembranes 1778 (2), 491-501, 2008
592008
Diphenylhexatriene membrane probes DPH and TMA-DPH: A comparative molecular dynamics simulation study
AMTM do Canto, JR Robalo, PD Santos, AJP Carvalho, JPP Ramalho, ...
Biochimica et Biophysica Acta (BBA)-Biomembranes 1858 (11), 2647-2661, 2016
582016
Cesiumauride Ammonia (1/1), CsAu⋅NH3: A Crystalline Analogue to Alkali Metals Dissolved in Ammonia?
AV Mudring, M Jansen, J Daniels, S Krämer, M Mehring, ...
Angewandte Chemie International Edition 41 (1), 120-124, 2002
582002
Fluorescence of nitrobenzoxadiazole (NBD)-labeled lipids in model membranes is connected not to lipid mobility but to probe location
M Amaro, HAL Filipe, JPP Ramalho, M Hof, LMS Loura
Physical Chemistry Chemical Physics 18 (10), 7042-7054, 2016
472016
DFT studies on thiophene acetylide Ru (II) complexes for nonlinear optics: Structure–function relationships and solvent effects
PJ Mendes, TJL Silva, AJP Carvalho, JPP Ramalho
Journal of Molecular Structure: THEOCHEM 946 (1-3), 33-42, 2010
392010
Behavior of fluorescent cholesterol analogues dehydroergosterol and cholestatrienol in lipid bilayers: a molecular dynamics study
JR Robalo, AMTM do Canto, AJP Carvalho, JPP Ramalho, LMS Loura
The Journal of Physical Chemistry B 117 (19), 5806-5819, 2013
332013
Design and development of molecularly imprinted polymers for the selective extraction of deltamethrin in olive oil: An integrated computational-assisted approach
N Martins, EP Carreiro, A Locati, JPP Ramalho, MJ Cabrita, AJ Burke, ...
Journal of Chromatography A 1409, 1-10, 2015
322015
Fluorescent membrane probes’ behavior in lipid bilayers: insights from molecular dynamics simulations
LMS Loura, JPP Ramalho
Biophysical reviews 1 (3), 141, 2009
312009
NBD-labeled cholesterol analogues in phospholipid bilayers: insights from molecular dynamics
JR Robalo, JPP Ramalho, LMS Loura
The Journal of Physical Chemistry B 117 (44), 13731-13742, 2013
302013
Density functional theory calculations on η5-monocyclopentadienylnitrilecobalt complexes concerning their second-order nonlinear optical properties
PJ Mendes, JPP Ramalho, AJE Candeias, MP Robalo, MH Garcia
Journal of Molecular Structure: THEOCHEM 729 (1-2), 109-113, 2005
272005
Behaviour of NBD-head group labelled phosphatidylethanolamines in POPC bilayers: a molecular dynamics study
HAL Filipe, LS Santos, JPP Ramalho, MJ Moreno, LMS Loura
Physical Chemistry Chemical Physics 17 (31), 20066-20079, 2015
242015
Cu (I) catalysed cyclopropanation of olefins: Stereoselectivity studies with Arylid-Box and Isbut-Box ligands
AJ Burke, E da Palma Carreiro, S Chercheja, NMM Moura, JPP Ramalho, ...
Journal of Organometallic Chemistry 692 (22), 4863-4874, 2007
242007
Molecular simulations of nitrogen adsorption in pure silica MCM-41 materials
AJP Carvalho, T Ferreira, AJE Candeias, JPP Ramalho
Journal of Molecular Structure: THEOCHEM 729 (1-2), 65-69, 2005
242005
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