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2012
Sousa, Ana M. M., Simone Morais, Maria H. Abreu, Rui Pereira, Isabel Sousa-Pinto, Eurico J. Cabrita, Cristina Delerue-Matos, and Maria Pilar Gonca̧lves. "Structural, Physical, and Chemical Modifications Induced by Microwave Heating on Native Agar-like Galactans." Jornal of Agricultural and Food Chemistry . 60 (2012): 4977-4985. Abstract

Native agars from Gracilaria vermiculophylla produced in sustainable aquaculture systems (IMTA) were extracted under conventional (TWE) and microwave (MAE) heating. The optimal extracts from both processes were compared in terms of their properties. The agars’ structure was further investigated through Fourier transform infrared and NMR spectroscopy. Both samples showed a regular structure with an identical backbone, β-D-galactose (G) and 3,6-anhydro-α-L-galactose (LA) units; a considerable degree of methylation was found at C6 of the G units and, to a lesser extent, at C2 of the LA residues. The methylation degree in the G units was lower for MAEopt agar; the sulfate content was also reduced. MAE led to higher agar recoveries with drastic extraction time and solvent volume reductions. Two times lower values of [η] and Mv obtained for the MAEopt sample indicate substantial depolymerization of the polysaccharide backbone; this was reflected in its gelling properties; yet it was clearly appropriate for commercial application in soft-texture food products.

Morgado, Carmen, and Fernanda Barbosa A Structured Approach to Problem Solving in CS1. Proc. of 17th Annual Conference on Innovation and Technology in Computer Science Education (ITICSE). Haifa, Israel, 2012.
Guimarães, D., M. L. Carvalho, V. Geraldes, I. Rocha, and J. P. Santos. "Study of lead accumulation in bones of Wistar rats by X-ray fluorescence analysis: aging effect." Metallomics. 4 (2012): 66. AbstractWebsite

The accumulation of lead in several bones of Wistar rats with time was determined and compared Q3 for the different types of bones. Two groups were studied: a control group (n = 20), not exposed to lead and a contaminated group (n = 30), exposed to lead from birth, first indirectly through
mother’s milk, and then directly through a diet containing lead acetate in drinking water (0.2%). Rats age ranged from 1 to 11 months, with approximately 1 month intervals and each of the collections had 3 contaminated rats and 2 control rats. Iliac, femur, tibia–fibula and skull have been analysed by energy dispersive X-ray fluorescence technique (EDXRF). Samples of formaldehyde used to preserve the bone tissues were also analysed by Electrothermal Atomic Absorption (ETAAS), showing that there was no significant loss of lead from the tissue to the preservative. The bones mean lead concentration of exposed rats range from 100 to 300 mg g 1 while control rats never exceeded 10 mg g 1. Mean bone lead concentrations were compared and
the concentrations were higher in iliac, femur and tibia–fibula and after that skull. However, of all the concentrations in the different collections, only those in the skull were statistically Q4 significantly different (p o 0.05) from the other types of bones. Analysis of a radar chart also allowed us to say that these differences tend to diminish with age. The Spearman correlation test applied to mean lead concentrations showed strong and very strong positive correlations between
all different types of bones. This test also showed that mean lead concentrations in bones are negatively correlated with the age of the animals. This correlation is strong in iliac and femur and very strong in tibia–fibula and skull. It was also shown that the decrease of lead accumulation with age is made by three plateaus of accumulation,

Bernardo, M., N. Lapa, M. Gonçalves, B. Mendes, and F. Pinto. "Study of the organic extraction and acid leaching of chars obtained in the pyrolysis of plastics, tire rubber and forestry biomass wastes." Procedia Engineering. 42 (2012): 1909-1916. AbstractWebsite

The present work aims to perform a characterization of chars obtained in the co-pyrolysis of waste mixtures composed by plastics, tires and pine biomass, to provide knowledge about the composition, leaching behavior and risk assessment of these materials in order to define strategies for their possible valorization or safe disposal. The chars were submitted to sequential solvent extractions with organic solvents of increasing polarity that allow the recovery of significant amounts of the pyrolysis oils trapped in the crude chars improving the yield of the pyrolysis liquids. An acidic demineralization procedure was successfully applied to the chars and high efficiency removals of the majority of the heavy metals were achieved. The demineralization study also demonstrated that hazardous heavy metals such as chromium, nickel and cadmium are significantly immobilized in the char matrix, and other heavy metals of concern such as zinc and lead will not represent a leaching problem if acidic conditions were not used. The obtained chars present sufficient quality and characteristics to be used as fuel or alternatively, to be used as adsorbents or precursors of activated carbon.

da Silva, Mara Soares, Raquel Viveiros, Mónica B. Coelho, Ana Aguiar-Ricardo, and Teresa Casimiro. "Supercritical CO2-assisted preparation of a PMMA composite membrane for bisphenol A recognition in aqueous environment." Chemical Engineering Science. 68 (2012): 94-100. AbstractPDFWebsite

This work reports a novel strategy to prepare affinity composite membranes using supercritical fluid technology. By blending molecularly imprinted polymeric particles with PMMA, a porous hybrid structure with affinity to the template molecule, bisphenol A, was prepared using a supercritical carbon dioxide (scCO2)-assisted method. Membranes were characterized in terms of morphology, mechanical performance and transport properties. The ability of the polymers and hybrid membranes to adsorb bisphenol A was tested in aqueous solutions and fitted to a linearized Langmuir equation, showing that adsorption takes place at homogeneous affinity binding sites within the imprinted surface. Filtration experiments showed that the imprinted hybrid membrane was able to adsorb higher amounts of template even in non-equilibrium dynamic binding conditions. The hybridization of the PMMA membrane herein reported conveys two important improvements over neat PMMA membrane: it introduced molecular affinity towards the template molecule and significantly increased the permeability of the porous structures, which are key parameters in processes that involve membranes. This technique could expand the applications of polymeric beads powders and enhance the efficiency of the membrane's transport properties. Our work presents a new method to confer affinity to a porous structure by immobilization of imprinted polymers, combining polymer synthesis and membrane formation using supercritical fluid technology.

da Silva, Mara Soares, Raquel Viveiros, Ana Aguiar-Ricardo, Vasco D. B. Bonifacio, and Teresa Casimiro. "Supercritical fluid technology as a new strategy for the development of semi-covalent molecularly imprinted materials." RSC Adv.. 2 (2012): 5075-5079. AbstractPDFWebsite

Molecularly imprinted polymeric particles with molecular recognition towards Bisphenol A (BPA) were synthesized for the first time using the semi-covalent imprinting approach in supercritical carbon dioxide (scCO2). The material{'}s affinity to BPA was achieved by co-polymerizing ethylene glycol dimethacrylate (EGDMA) with a template-containing monomer{,} Bisphenol A dimethacrylate (BPADM) in scCO2. Bisphenol A is then cleaved from the polymeric matrix by hydrolysis with tetrabutylammonium hydroxide (n-Bu4OH) also in a supercritical environment{,} taking advantage of the high diffusivity of scCO2. The selectivity of the molecular imprinted polymer (MIP) was assessed by evaluating its capability to bind BPA in comparison with progesterone and [small alpha]-ethinylestradiol. In addition{,} the cross-linked particles were used to prepare a PMMA-based hybrid imprinted membrane by a scCO2-assisted phase inversion method. Results show that the incorporation of MIP particles was able to confer molecular affinity to BPA to the membrane and that at dynamic conditions of filtration{,} this imprinted porous structure was able to adsorb a higher amount of BPA than the corresponding non-imprinted hybrid membrane. Our work represents a valuable greener alternative to conventional methods{,} for the synthesis of affinity materials which are able to maintain molecular recognition properties in water.

Ganhao, Antonio M., and Miguel P. Amado Sustainable Construction: Energy Efficiency in Residential Buildings. BSA 2012 – 1st International Conference on Building Sustainability Assessment. Porto, PT: Green Lines Institute, 2012.sustainable_construction_-_energy_efficiency_in_residential_buildings_bsa_2012.pdf
Fino, M., and F. Coito. "Symbolic Characterization of VCOs and its application to optimization based design." Design of Analog Circuits Through Symbolic Analysis. Eds. M. FahkFahk, F. V. Fernandez, and E. Tlelo-Cuautle. Bentham Sciences Publishers Ltd, 2012. 399-412.
Martins, R. M. S., F. Beckmann, R. Castanhinha, O. Mateus, R. Araújo, and P. K. Pranzas Synchrotron radiation-based micro-computed tomography applied to the characterization of dinosaur fossils from the Lourinhã Formation. 1 st . Meeting of Synchrotron Radiation Users from Portugal. Caparica, Portugal, 2012.martins_et_al_2012_tomography_enurs_martins-rui_dinosaurfossils.pdf
Enugala R., Marques M. M. B. *. "Synthesis of a 3-hydroxyl- free N-acetyl glucosamine disaccharide." Arkivoc. vi (2012): 90-100.
Faísca-Phillips, A. M., and M. T. Barros. "Synthesis of geminal bisphosphonates via organocatalyzed enantioselective Michael additions of cyclic ketones and 4-piperidones." Org. Biomol. Chem.. 10 (2012): 404-412.
Pinto, R. M., A. A. Dias, M. Coreano, M. de Simone, B. M. Giuliano, J. P. Santos, and M. L. Costa. "Tautomerism in 5-aminotetrazole investigated by core-level photoelectron spectroscopy and ΔSCF calculations." J. Electron. Spectrosc. Related Phenomena. 185 (2012): 13-17. AbstractWebsite

The C 1s and N 1s photoelectron spectra of gas-phase 5-aminotetrazole (5ATZ) were recorded using synchrotron radiation, with the aim of evaluating 1H/2H tautomer population ratios. The core-electron binding energies (CEBEs) were estimated from computational results, using the delta self-consistent-field (ΔSCF) approach. Simulated spectra were generated using these CEBEs and the results from Gaussian-n (Gn, n=1, 2 and 3) and Complete Basis Set (CBS-4M and CBS-Q) methods. Results reveal the almost exclusive predominance of the 2H-tautomer, with a 1H/2H ratio of ca. 0.12/0.88, taken from a gross analysis of the XPS C 1s spectrum, recorded at 365 K.

Huang, J., Vicente M. da Silva, and K. Krabbenhoft. "Three-dimensional granular contact dynamics with rolling resistance." Computers and Geotechnics (2012): In Press.
João, Costa, Ortigueira Manuel, Batista Arnaldo, and Paiva Teresa. "Threshold choice for automatic spindle detection." IWSSIP 2012: 19th International Conference on Systems, Signals and Image Processing. 2012.
Martins, R. M. S., R. Araújo, O. Mateus, R. Castanhinha, P. K. Pranzas, and F. Beckmann. "Tomography applied to the study of dinosaur fossils from the collection of the museum of Lourinhã (Portugal)." I Congresso Internacional GeoCiencias na CPL. Coimbra: Univ. Coimbra, 2012. martins_et_al_2012_abstract.pdf
Cunha, Jácome, João P. Fernandes, Hugo Ribeiro, and João Saraiva. "Towards a Catalog of Spreadsheet Smells." Proceedings of the 12th International Conference on Computational Science and Its Applications - Volume Part IV. ICCSA'12. Berlin, Heidelberg: Springer-Verlag, 2012. 202-216. Abstracticcsa-sq12.pdf

Spreadsheets are considered to be the most widely used programming language in the world, and reports have shown that 90% of real-world spreadsheets contain errors. In this work, we try to identify spreadsheet smells, a concept adapted from software, which consists of a surface indication that usually corresponds to a deeper problem. Our smells have been integrated in a tool, and were computed for a large spreadsheet repository. Finally, the analysis of the results we obtained led to the refinement of our initial catalog.

Cunha, Jácome, João Paulo Fernandes, Jorge Mendes, and João Saraiva. "Towards an Evaluation of Bidirectional Model-driven Spreadsheets." User evaluation for Software Engineering Researchers. USER' 12. ACM Digital Library, 2012. 25-28. Abstractuser12.pdf

Spreadsheets are widely recognized as popular programming systems with a huge number of spreadsheets being created every day. Also, spreadsheets are often used in the decision processes of profit-oriented companies. While this illustrates their practical importance, studies have shown that up to 90% of real-world spreadsheets contain errors. In order to improve the productivity of spreadsheet end-users, the software engineering community has proposed to employ model-driven approaches to spreadsheet development. In this paper we describe the evaluation of a bidirectional model-driven spreadsheet environment. In this environment, models and data instances are kept in conformity, even after an update on any of these artifacts. We describe the issues of an empirical study we plan to conduct, based on our previous experience with end-user studies. Our goal is to assess if this model-driven spreadsheet development framework does in fact contribute to improve the productivity of spreadsheet users.

Amado, M. P., and F. Poggi. "Towards Solar Urban Planning: a new step for better energy performance." Energy Procedia .30 (2012): 1261-1273.towards_solar_urban_planning.pdf
del Victoria, Mar Cólas M. ª, Arnaud Mazars, and Rui Micaelo TRACC Project: Road techniques adapted to climate change. 5th Congress Eurasphalt & Eurobitume 2012. Istanbul, Turkey, 2012.
Baquinha, Pedro, Rodrigo Martins, Luis Pereira, and Elvira Fortunato Transparent Oxide Electronics. Wiley, 2012.
Correia, Isabel, Teresa Melo, and Francisco Saldanha-da-Gama. "A two-echelon facility location problem with layout selection." Mathematics and Computers in Science and Engineering 3. 2012. Abstract

n/a

Baptista, Susana, Maria Isabel Gomes, and Ana Paula Barbosa-povoa. "A Two-Stage Stochastic Model for the Design and Planning of a Multi-Product Closed Loop Supply Chains." 22nd European Symposium on Computer Aided Process Engineering. Eds. Ian David Lockhart Bogle, and Michael Fairweather. Vol. 30. Computer Aided Chemical Engineering, 30. London: Elsevier, 2012. 412-416. Abstractpreprint_baptistagomesbarbosa-povoa2012_escape22.pdf

In this paper we address the problem of uncertainty in the design and planning of a multi-period, multi-product closed loop supply chain, where the recovered products are end-of-life products that are disassembled and recycled. Uncertainty is explicitly modelled by considering customers’ demands and returns to be stochastic. A two–stage model is developed where first stage decisions concern the facility location while second stage decisions are the production planning of the supply chain. The integer L- shaped method was adopted as the solution tool and computational tests were performed on multi-period and multi-commodity networks randomly generated based on a reference case. A comparison between the proposed solution method and the straight use of the CPLEX is performed.

Gião, R., V. Lúcio, C. Chastre, and A. Bras UFRG – Unidirectional fibre reinforced grout as strengthening material for reinforced concrete structures. BEFIB2012 – Fibre reinforced concrete. Guimarães: UMinho, 2012. Abstract

The present study is part of an extensive research project, where the main objective is to evaluate a strengthening solution for reinforced concrete structures using a small thickness jacketing in the compression side of the RC element with unidirectional fiber reinforced grout - UFRG.
For this purpose a high performance cementitious grout reinforced with continuous and unidirectional non woven fibermat has been developed. It was expected that the use of these type of fibers allowed an optimization of its percentage and orientation. It was expected that the use of these type of fibers allowed an optimization of its percentage and orientation. Besides, for continuous fibers (with an aspect ratio, defined as the length-to-diameter ratio, l/d=∞), the composite should attain higher tensile strength since the fiber embedment length is enough to prevent fiber pullout.
The experimental campaign included a set of preliminary tests that allowed the design of the fiber reinforced grout, sustained with rheological parameters [7] and mechanical characterization tests of the materials.
Finally, an experimental campaign was carried out in order to proceed to the mechanical characterization of the unidirectional fiber reinforced grout. Compressive tests were conducted in small thickness tubular specimens that enable the determination of the compressive strength and the static modulus of elasticity of the material. The tensile strength of the material was obtained using splitting tests of cubic specimens (according the standard DIN 1048-5). The experimental results are presented and analyzed.

Zeballos, Luis J., Maria Isabel Gomes, Ana Paula Barbosa-póvoa, and Augusto Q. Novais. "Uncertain quality and quantity of returns in a closed-loop supply chain." Foundations of Computer-aided Process Operations. Savannah, USA 2012. Abstract

In this work the design and planning of a Closed-Loop Supply Chain (CLSC) under uncertain conditions is considered and a two-stage scenario-based modeling approach is proposed in order to deal with this multi-product, multi-period problem. The network design and tactical plan are simultaneously optimized in a given time horizon, comprehending the raw material acquisition and the processing, storage and distribution of intermediates, returns and final products. Uncertainty is associated to the returns, both in terms of their quantity, which is customer dependent, and quality, which is determined at the sorting centers. Therefore, the ensuing mathematical MILP formulation considers the simultaneous integration of two important uncertainty sources, which represents an important modeling advantage, allowing a better understanding of the reverse network structure. For each probabilistic scenario, the model estimates the amount of products to be returned by customers and of returns to be remanufactured for each quality level, as well as the storage levels. Several tests based on a real sized example of a Portuguese glass company are undertaken in order to show the applicability of the developed approach. Based on these tests, the influence of the uncertain quality and quantity of returns on the design and planning of the CLSC is assessed.