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A combined LS-SVM & MLR QSAR workflow for predicting the inhibition of CXCR3 receptor by quinazolinone analogs
(2010)
AnovelQSARworkflowis constructed that combines MLR with LS-SVM classification techniques for the identification of quinazolinone analogs as "active" or "nonactive" CXCR3 antagonists. The accuracy of the LS-SVM classification ...
Ligand - Based virtual screening procedure for the prediction and the identification of novel β-amyloid aggregation inhibitors using Kohonen maps and Counterpropagation Artificial Neural Networks
(2011)
In this work we have developed an in silico model to predict the inhibition of β-amyloid aggregation by small organic molecules. In particular we have explored the inhibitory activity of a series of 62 N-phenylanthranilic ...
Enabling cross-platform mobile application development: A context-aware middleware
(2014)
The emergence of mobile computing has changed the rules of web application development. Since context-awareness has become almost a necessity in mobile applications, web applications need to adapt to this new reality. A ...
Business-Oriented Evaluation of the PaaSage Platform
(Institute of Electrical and Electronics Engineers Inc., 2015)
Cloud computing is an efficient and cost effective realization of the utility function principle. Over the last years, a vast pool of choices for businesses has been created. This diversity of cloud infrastructures, ...
A framework for dynamic validation of context-aware applications
(2012)
The development of context-aware applications is a complex process that involves the tasks of analysis, design, validation and implementation. This process is typically performed using context modelling approaches that ...
"Squaring the clusters": A Mn III 4Ni II 4 molecular square from nickel(ii)-induced structural transformation of a Mn II/III/IV 12 cage
(2012)
A Mn III 4Ni II 4 molecular square exhibiting slow magnetization relaxation has been prepared from the reaction of a Mn II 4Mn III 6Mn IV 2 cluster and a simple Ni II source. © The Royal Society of Chemistry 2012.
Surface reactivity of LaCoO3 and Ru/LaCoO3 towards CO, CO2 and C3H8: Effect of H2 and O2 pretreatments
(2011)
The differences in surface reactivity of LaCoO3 and Ru/LaCoO3 solids after pre-treatment in a hydrogen or oxygen gas atmosphere towards oxidative steam reforming (OSR) of propane was probed by performing temperature-programmed ...
Approaches to molecular magnetic materials from the use of cyanate groups in higher oxidation state metal cluster chemistry: Mn14 and Mn 16
(2013)
The initial employment of cyanato groups in higher oxidation state manganese cluster chemistry, in conjunction with the gem-diolate form of di-2-pyridylketone or 2,6-diacetylpyridine dioxime chelate ligands, has afforded ...
A distributed algorithm for gathering many fat mobile robots in the plane
(2013)
We revisit the problem of gathering autonomous robots in the plane. In particular, we consider non-transparent unit-disc robots (i.e., fat) in an asynchronous setting with vision as the only means of coordination and robots ...