Geobacter sulfurreducens is a sediment bacterium that contains a large number of multiheme cytochromes. The family of five c7 triheme periplasmic cytochromes from Geobacter sulfurreducens shows structural diversity of the heme core. Structural characterization of the relative orientation of the axial ligands of these proteins by 13C-paramagnetic NMR was carried out. The structures in solution were compared with those obtained by X-ray crystallography. For some hemes significant differences exist between the two methods such that orientation of the magnetic axes obtained from NMR data and the orientation taken from the X-ray coordinates differ. The results allowed the orientation of the magnetic axes to be defined confidently with respect to the heme frame in solution, a necessary step for the use of paramagnetic constraints to improve the complete solution structure of these proteins.

The phase transformations of the surfactant Triton X-100 were investigated by differential scanning calorimetry (DSC), polarized optical microscopy (POM), and dielectric relaxation spectroscopy (DRS). In particular, crystallization was induced at different cooling rates comprised between 13 and 0.5 K min–1. Vitrification was detected by both DSC and DRS techniques with a glass transition temperature of 212 K (measured on heating by DSC) allowing classifying Triton X-100 as a glass former. A fully amorphous material was obtained by cooling at a rate ≥10 K min–1, while crystallization was observed for lower cooling rates. The temperature of the onset of melt-crystallization was found to be dependent on the cooling scan rate, being higher the lower was the scan rate. In subsequent heating scans, the material undergoes cold-crystallization except if cooled previously at a rate ≤1 K min–1. None of the different thermal histories led to a 100% crystalline material because always the jump typical of the glass transformation in both heat flux (DSC) and real permittivity (DRS) is observed. It was also observed that the extent/morphology of the crystalline phase depends on the degree of undercooling, with higher spherulites developing for lower undercooling degree (24 K ≤ Tm – Tcr ≤ 44 K) in melt-crystallization and a grain-like morphology emerging for Tm – Tcr ≈ 57 K either in melt- or cold-crystallization. The isothermal cold- and melt-crystallizations were monitored near above the calorimetric glass transition temperature by POM (221 K) and real-time DRS (Tcr = 219, 220, and 221 K) to evaluate the phase transformation from an amorphous to a semicrystalline material. By DRS, the α-relaxation associated with the dynamic glass transition was followed, with the observation that it depletes upon both type of crystallizations with no significant changes either in shape or in location. Kinetic parameters were obtained from the time evolution of the normalized permittivity according to a modified Avrami model taking in account the induction time. The reason the isothermal crystallization occurs to a great extent in the vicinity of the glass transition was rationalized as the simultaneous effect of (i) a high dynamic fragile behavior and (ii) the occurrence of catastrophic nucleation/crystal growth probably enabled by a preordering tendency of the surfactant molecules. This is compatible with the estimated low Avrami exponent (1.12 ≤ n ≤ 1.6), suggesting that relative short length scale motions govern the crystal growth in Triton X-100 coherent with the observation of a grainy crystallization by POM.

In this work, we systematically evaluated the potential of using boronic acid functionalized magnetic particles in the capturing of human immunoglobulin G under typical mammalian cell culture conditions. For comparison, Protein A coated magnetic particles were also used. The binding pH was found to significantly influence the adsorption isotherms of boronic acid particles with the higher capacities (0.216 g IgG/g support) being observed at pH 7.4. Comparatively, this value was 0.109 g IgG/g support, for Protein A particles under the same conditions. Both particles revealed very fast adsorption kinetics with more than 70% of the maximum binding capacity being achieved in a few seconds. The effect of glucose and lactate, which are known to interact with boronic acid, was evaluated. For glucose, the binding capacity was significantly influenced by the pH and decreased as pH increased. At pH 9.5, a 70% lower binding capacity was observed for glucose concentrations as low as 0.5 g/l. The effect of lactate was less pronounced and almost pH independent reaching at most 20% decrease in binding capacity. Nevertheless, the effect of both molecules was always lower at pH 7.4. The optimization of the elution conditions enabled complete recovery of bound IgG from boronic acid particles using 50mM Tris-HCl, 200 mM sorbitol, 200 mM NaCl at pH 8.5.

Transactional Memory (TM) is an approach to concurrency control in general pur- pose programming languages that inherits the concept of transaction from the database setting. Unlike other language constructs such as locks, TM has an optimistic approach to concurrency control by allowing more than one thread to access simultaneously the same critical section. A transaction always executes as if it is alone in the system, and in the end its effects are undone (rolled back) if it conflicts with another concurrent transac- tions. In spite of the potential for increasing scalability and performance, TM is a recent and developing programming model and still has a very limited impact in real-world applications.
Designing and developing concurrent software is difficult and error prone. Concur- rent programs exhibit concurrency anomalies that originate faults and failures. Despite some claims that TM programs are less error prone, they still exhibit concurrency anoma- lies such as high-level dataraces, i.e., wrong delimitations of transactions’ scope, and stale-value errors, that occur when the value of a shared variable jumps from an atomic block to another.
Programs with this kind of anomalies can exhibit unpredictable and wrong behaviour, not fulfilling the goals for which they were conceived.
This work aims the detection of anomalies through static analysis of transactional Java ByteCode programs that execute in strong atomicity. A extensible and flexible framework is proposed, which can be extended with plugins that detect specific types of anomalies. With this framework we expect to prove that high-level dataraces and stale-value errors can be detected with reasonable precision through static analysis.

Keywords: Atomicity Violation, High-Level Datarace, Static Analysis, Concurrency, Software Transactional Memory

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At the beginning of the 21st century there are new expectations and challenges towards Technology Assessment (TA). Among these there is a new awareness on TA issues in education, in particular at universities. While TA was mainly an activity at extra-universitarian research institutions for a long time now there are new developments and initiative towards integrating TA issues in university courses. We will first give an insight into the international development. Secondly we will focus on the “TA and education” landscape in Germany and Portugal in more detail, followed by a description of new and emerging forms of cooperation between Portugal and Germany in this field which might serve as a model or an example for further cooperation between other partners.

The ideas of ‘responsible development’ in the scientific-technological advance and of ‘responsible innovation’ in the field of new products, services and systems have been discussed for some years now with increasing intensity (Siune et al. 2009) and led to the phrase of ‘Responsible Research and Innovation’ (RRI). The postulate of responsible innovation adds explicit ethical reflection to Technology Assessment (TA) and science, technology and society (STS) studies and includes all of them into integrative approaches to shaping technology and innovation. Responsible innovation brings together TA with its experiences on assessment procedures, actor involvement, foresight and evaluation with ethics, in particular under the framework of responsibility, and also builds on the body of knowledge about R&D and innovation processes provided by STS and STIS studies (science, technology, innovation and society). Ethical reflection and technology assessment are increasingly taken up as integrative part of R&Dprogrammes (Siune et al. 2009). Science institutions, including research funding agencies, have started taking a pro-active role in promoting integrative research and development. Thus, the governance of science and of R&D processes is changing which opens up new possibilities and opportunities for involving new actors and new types of reflection. In this paper I want to demonstrate at a more conceptual level that Responsible Innovation can build on experiences and knowledge provided by the three mentioned fields of research: ethics, technology assessment, and STS respective STIS studies. To this end I will start by a brief analysis of the thematic dimensions included in the notion of responsibility and the respective disciplinary approaches to explore and investigate them (Sec. 2). The field of technology assessment is then introduced as a major origin of the Responsible Innovation movement including already some of the main ideas behind Responsible Innovation (Sec. 3). Based on the TA tradition Responsible Innovation may be characterized as a broadened extension of technology assessment complemented by ethics and STS (Sec. 4). As an illustration, the field of Synthetic Biology is introduced (Sec. 5).