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At least 1,657 records · Page 92

Metagenomic Insight into Environmentally Challenged Methane-Fed Microbial Communities

In this study, we aimed to investigate, through high-resolution metagenomics and metatranscriptomics, the composition and the trajectories of microbial communities originating from a natural sample, fed exclusively with methane, over 14 weeks of laboratory incubation. This study builds on our prior data, suggesting that multiple functional guilds feed on methane, likely through guild-to-guild carbon transfer, and potentially through intraguild and intraspecies interactions. We observed that, under two simulated dioxygen partial pressures—low versus high—community trajectories were different, with considerable variability among the replicates. In all microcosms, four major functional guilds were prominently present, representing Methylococcaceae (the true methanotrophs), Methylophilaceae (the nonmethanotrophic methylotrophs), Burkholderiales, and Bacteroidetes. Additional functional guilds were detected in multiple samples, such as members of Opitutae, as well as the predatory species, suggesting additional complexity for methane-oxidizing communities. Metatranscriptomic analysis suggested simultaneous expression of the two alternative types of methanol dehydrogenases in both Methylococcaceae and Methylophilaceae, while high expression of the oxidative/nitrosative stress response genes suggested competition for dioxygen among the community members. The transcriptomic analysis further suggested that Burkholderiales likely feed on acetate that is produced by Methylococcaceae under hypoxic conditions, while Bacteroidetes likely feed on biopolymers produced by both Methylococcaceae and Methylophilaceae.

59 BASIC BIOLOGICAL SCIENCES↗

ROTATIONAL DYNAMICS AND STAR FORMATION IN THE NEARBY DWARF GALAXY NGC 5238

We present new H i spectral-line images of the nearby low-mass galaxy NGC 5238, acquired with the Karl G. Jansky Very Large Array. Located at a distance of 4.51 ± 0.04 Mpc, NGC 5238 is an actively star-forming galaxy with widespread H α and ultraviolet (UV) continuum emission. The source is included in many ongoing and recent nearby galaxy surveys, but until this work the spatially resolved qualities of its neutral interstellar medium have remained unstudied. Our H i images resolve the disk on physical scales of ∼400 pc, allowing us to undertake a detailed comparative study of the gaseous and stellar components. The H i disk is asymmetric in the outer regions, and the areas of high H i mass surface density display a crescent-shaped morphology that is slightly offset from the center of the stellar populations. The H i column density exceeds 10{sup 21} cm{sup −2} in much of the disk. We quantify the degree of co-spatiality of dense H i gas and sites of ongoing star formation as traced by far-UV and H α emission. The neutral gas kinematics are complex; using a spatially resolved position–velocity analysis, we infer a rotational velocity of 31 ± 5 km s{sup −1}. We place NGC 5238 on the baryonic Tully–Fisher relation and contextualize the system among other low-mass galaxies.

79 ASTRONOMY AND ASTROPHYSICS↗

Dynamical estimate of post-main-sequence stellar masses in 47 Tucanae

We use the effects of mass segregation on the radial distribution of different stellar populations in the core of 47 Tucanae to find estimates for the masses of stars at different post-main-sequence evolutionary stages. We take samples of main-sequence (MS) stars from the core of 47 Tucanae, at different magnitudes (i.e., different masses), and use the effects of this dynamical process to develop a relation between the radial distance (RD) at which the cumulative distribution reaches the 20th and 50th percentile and stellar mass. From these relations we estimate the masses of different post-MS populations. We find that mass remains constant for stars going through the evolutionary stages from the upper MS up to the horizontal branch (HB). By comparing RDs of the HB stars with stars of lower masses, we can exclude a mass loss greater than 0.09 M{sub ⊙} during the red giant branch (RGB) stage at nearly the 3σ level. The slightly higher mass estimates for the asymptotic giant branch (AGB) are consistent with the AGB having evolved from somewhat more massive stars. The AGB also exhibits evidence of contamination by more massive stars, possibly blue straggler stars (BSSs), going through the RGB phase. We do not include the BSSs in this paper due to the complexity of these objects; instead, the complete analysis of this population is left for a companion paper. The process to estimate the masses described in this paper is exclusive to the core of 47 Tuc.

79 ASTRONOMY AND ASTROPHYSICS↗

Ideas and perspectives: Enhancing research and monitoring of carbon pools and land-to-atmosphere greenhouse gases exchange in developing countries

Carbon (C) and greenhouse gas (GHG) research has traditionally required data collection and analysis using advanced and often expensive instruments, complex and proprietary software, and highly specialized research technicians. Partly as a result, relatively little C and GHG research has been conducted in resource-constrained developing countries. At the same time, these are often the same countries and regions in which climate change impacts will likely be strongest and in which major science uncertainties are centered, given the importance of dryland and tropical systems to the global C cycle. Increasingly, scientific communities have adopted appropriate technology and approach (AT&A) for C and GHG research, which focuses on low-cost and low-technology instruments, open-source software and data, and participatory and networking-based research approaches. Adopting AT&A can mean acquiring data with fewer technical constraints and lower economic burden and is thus a strategy for enhancing C and GHG research in developing countries. However, AT&A can have higher uncertainties; these can often be mitigated by carefully designing experiments, providing clear protocols for data collection, and monitoring and validating the quality of obtained data. For implementing this approach in developing countries, it is first necessary to recognize the scientific and moral importance of AT&A. At the same time, new AT&A techniques should be identified and further developed. All these processes should be promoted in collaboration with local researchers and through training local staff and encouraged for wide use and further innovation in developing countries.

Kim, Dong-Gill↗

RISK MONITORING CAPABILITES FROM DYNAMIC PRA DATA

Risk Monitors (RMs) are software tools that are employed in nuclear power plants to monitor the safety properties of the plant itself during operation. These safety properties are generated using classical PRA methods which are typically based on static Boolean structures such as Fault-Trees (FTs) and Event-Trees (ETs). The outcomes of these methods are Core Damage Frequency (CDF) and risk importance values of plant components (e.g., valves and pumps). Examples of Risk Importance Measures (RIMs) commonly used are: Risk Achievement Worth (RAW), Risk Reduction Worth (RRW), Birnbaum (B) and Fussell-Vesely (FV) [1,2]. In a RM these values are updated in real time once plant components status is updated (e.g., under maintenance, off-line, testing). In addition, RMs can be used to optimize maintenance schedules so those safety features of the plant are below plant standard values. This paper presents an approach to create temporal profiles of RIMs (i.e., RM capabilities) given a temporal change of the plant configuration. Instead of employing data generated by ETs and FTs, the proposed approach will employ data generated by Dynamic PRA methods. In contrast to classical PRA methods, Dynamic PRA methods couple stochastic methods with safety analysis codes to determine risk associate to complex systems such as nuclear plants. Compared to classical PRA methods, they can evaluate with higher resolution the safety impact of timing and sequencing of events on the accident progression. We will describe how classical RIMs can be generated by Dynamic PRA data and then we will show how the temporal profiles of the RIMs can be generated given a temporal profile of the system configuration.

97 MATHEMATICS AND COMPUTING↗

Commercial Building Sensors and Controls Systems: Barriers, Drivers, and Costs

Building sensors and controls systems, including building automation systems, consists of the sensor-based devices installed in buildings and the control and automation of those devices. Optimized sensors and controls systems could lead to 29% annual energy savings in commercial buildings and are integral to the growth of grid-interactive efficient buildings. Only 8% of small commercial buildings, however, have installed sensors and controls systems. This is largely due to cost barriers. This work seeks to increase the transparency of system costs and identify specific barriers and drivers for increased adoption. To gather industry insights, the team reached out to building owners, vendors, and contractors and conducted 20 interviews with the goal of collecting cost data and market characteristics regarding building sensors and controls. The qualitative interview data was analyzed using grounded theory to identify overarching concepts, such as barriers, drivers, and future directions on the field. From this analysis, primary barriers were found to be complexity, a lack of knowledge, and money. Primary drivers were found to be the knowledge of data, savings, and remote access. The qualitative cost data was collected in the form of invoices during the interviews. The cost values were used to develop a percentage-based cost stack which identifies the average fraction of the total cost attributed to each category (hardware, software, labor, fees, and taxes). This greater understanding of costs and barriers associated with commercial building sensors and controls systems lays the groundwork for future steps in increasing system adoption, reducing energy consumption, and market transformation.

advanced building controls↗

Dynamics of Multilayer Complex Infrastructure Networks

Our research effort models critical infrastructure systems as complex and interdependent networks, allowing for dynamic analysis of the resilience and robustness of these connected systems.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗

Neutronics Analysis for ITER Diagnostic Generic Upper Port Plug

This paper presents new results of neutronics analysis performed for the updated design of the ITER Diagnostic Generic Upper Port Plug (DGUPP). Such analysis is performed regularly during the development of the ITER Ports design. Neutronics analysis is an important step in support of the development of ITER components irradiated by 14 MeV neutrons generated in D-T fusion thermonuclear reactions. The neutrons are born in the ITER tokamak plasma chamber and then impinge on the surrounding blanket and port plugs, after that they diffuse through shielding material of vacuum vessel components or could stream through the diagnostic channels and assembly gaps far away from plasma up to the bio-shield and in a small amount beyond it. While ITER machine is in operation it is inaccessible, after the shut-down it is planned to provide personnel access to the Upper Port Inter-Space Structure (UP ISS) behind the Port Plug via the corridors. Neutrons activate the ITER materials and those radioactive materials emit decay gammas during the shut-down causing a Shut-Down Dose Rate (SDDR) field distributed all around the activated materials. Decay gammas could also stream through the void channels. That emphasizes the need for calculation of decay gamma transport in evaluations of SDDR, which is reflected in the use of transport - activation interface code described in Section of Computational Modelling. The assessment of radiation environment (fluxes and SDDR) at DGUPP was focused on the port back-side area of UP ISS, where personnel access is planned along the ISS maintenance corridors. Minimization of SDDR at the front part of the ISS maintenance corridors was the target value for optimization of the DGUPP shielding and analysis of related neutronics effects. Following the dose ALARA (As Low As Reasonably Achievable) principle, every possibility to reduce SDDR should be investigated, emphasizing the importance of this analysis. The challenges of such analysis are inextricably connected with the engineering complexity of the ITER machine, with integration of many diagnostics systems having channels and gaps inside the ITER ports. Those gaps result in radiation streaming and negatively affect the shielding performance of the port plugs. The computational complication is caused by the need to model precisely the ITER geometry and then to run deep penetrating radiation transport in the substantially heterogenic toroidal geometry of ITER large-size tokamak, with 30 m height and diameter of its bio-shield. The whole mass of Upper Port Plug (UPP) could be up to 25 tons and it must be very precisely positioned inside the port opening in blanket and Vacuum Vessel. Facing the engineering challenges for the assembly of DGUPP, there were proposed two Project Change Requests (PCRs) No. 439 and 709 concerning the design updates of UPP/blanket interface and its remote handling.

61 RADIATION PROTECTION AND DOSIMETRY↗

SFDS: The criticality assembly for the experimental research of the nuclear spent fuel dissolver in CIAE - 14401

SFDS is the criticality assembly for the experimental research of the spent fuel dissolver in China Institute of Atomic Energy. The spent fuel dissolver, as the bottleneck of spent fuel reprocessing, has so many characteristics such as the dynamic changes, heterogeneous distribution, complex compositions that it is hard to analysis by theoretical method. Without enough experiments, clear bias and uncertainty of the analysis tools the handling limits for criticality safety in dissolver can't be determined. The SFDS, physical designed by MONK 9A code, uses two kinds of nuclear fuels, 3% enrichment solid UO{sub 2} rods and 5.5% enrichment UO{sub 2}(NO{sub 3}){sub 2} solution, will meet the demand of the critical experiments about the dissolvers. Seven series of critical experiments will be present on it, those are on pitches of rods, uranium concentrations of solutions, nitric acid concentrations of solutions, fission products, void fractions, temperatures and dissolve phases. More kinds of experiments could be introduced with the flexible structures of SFDS in the future. The current work on it are testing and debugging with full systems by water and it will be first critical later in 2015. It will become the first benchmark assembly for critical experiments research in the nuclear fuel cycle system in China. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Two new marine hermit crabs allied with the Paguristes tortugae complex (Crustacea: Decapoda: Anomura) from the western Atlantic

A recent molecular phylogenetic analysis that focused on selected species of western Atlantic Paguristes Dana, 1851, Areopaguristes Rahayu & McLaughlin, 2010, and Pseudopaguristes McLaughlin, 2002 was somewhat inconclusive regarding relationships among those genera, but it revealed two new unrecognized species genetically related to members of the Paguristes tortugae complex. One of the new species is sister to A. hummi (Wass, 1955), which is readily separated from Wass’ taxon by significant differences in coloration. However, no definitive characters have been found for its identification on the basis of structural morphology. A second new species is genetically sister to P. tortugae Schmitt, 1933, even though it was regarded in earlier literature as no more than an ecomorphic variant expressing protective coloration related to habitat substrate color. In addition to its unique coloration, subtle distinctions are evident in structural morphology. Both species are formally named with accompanying morphological and color descriptions.

Zoology↗

Genome Sequencing and Comparative Analysis of the Biocontrol Agent Trichoderma harzianum sensu stricto TR274

Biological control is a complex process which requires many mechanisms and a high diversity of biochemical pathways. The species of Trichoderma harzianum are well known for their biocontrol activity against many plant pathogens. To gain new insights into the biocontrol mechanism used by T. harzianum, we sequenced the isolate TR274 genome using Illumina. The assembly was performed using AllPaths-LG with a maximum coverage of 100x. The assembly resulted in 2282 contigs with a N50 of 37033bp. The genome size generated was 40.8 Mb and the GC content was 47.7%, similar to other Trichoderma genomes. Using the JGI Annotation Pipeline we predicted 13,932 genes with a high transcriptome support. CEGMA tests suggested 100% genome completeness and 97.9% of RNA-SEQ reads were mapped to the genome. The phylogenetic comparison using orthologous proteins with all Trichoderma genomes sequenced at JGI, corroborates the Trichoderma (T. asperellum and T. atroviride), Longibrachiatum (T. reesei and T. longibrachiatum) and Pachibasium (T. harzianum and T. virens) section division described previously. The comparison between two Trichoderma harzianum species suggests a high genome similarity but some strain-specific expansions. Analyses of the secondary metabolites, CAZymes, transporters, proteases, transcription factors were performed. The Pachybasium section expanded virtually all categories analyzed compared with the other sections, specially Longibrachiatum section, that shows a clear contraction. These results suggests that these proteins families have an important role in their respective phenotypes. Future analysis will improve the understanding of this complex genus and give some insights about its lifestyle and the interactions with the environment.

Steindorff, Andrei S.↗

Spectroscopic and thermogravimetric study of nickel sulfaquinoxaline complex

The ability of sulfaquinoxaline (4-Amino-N-2-quinoxalinylbenzenesulfonamide) to form metal complexes are investigated. The nickel complex of sulfaquinoxaline is prepared by reflux method and characterized by CHN analysis and IR spectra. The results of IR spectral data suggest that the binding of nickel atom to the sulfonamidic nitrogen are in good agreement. The thermogravimetric analysis (TGA), differential thermal analysis (DTA) and differential thermogravimetric (DTG) analysis of nickel sulfaquinoxaline are carried out from ambient temperature to 750°C in inert nitrogen atmosphere. The activation energy, enthalpy, entropy and Gibbs free energy of nickel sulfaquinoxaline complex is determined from the thermal curves using Broido method. The results are reported in this paper.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Operando pair distribution function analysis of nanocrystalline functional materials: the case of TiO 2 -bronze nanocrystals in Li-ion battery electrodes

Structural modelling of operando pair distribution function (PDF) data of complex functional materials can be highly challenging. To aid the understanding of complex operando PDF data, this article demonstrates a toolbox for PDF analysis. The tools include denoising using principal component analysis together with the structureMining , similarityMapping and nmfMapping apps available through the online service `PDF in the cloud' ( PDFitc , https://pdfitc.org/). The toolbox is used for both ex situ and operando PDF data for 3 nm TiO 2 -bronze nanocrystals, which function as the active electrode material in a Li-ion battery. The tools enable structural modelling of the ex situ and operando PDF data, revealing two pristine TiO 2 phases (bronze and anatase) and two lithiated Li x TiO 2 phases (lithiated versions of bronze and anatase), and the phase evolution during galvanostatic cycling is characterized.

Chemistry↗

A Click‐Chemistry‐Based Enrichable Crosslinker for Structural and Protein Interaction Analysis by Mass Spectrometry

Abstract Mass spectrometry is the method of choice for the characterisation of proteomes. Most proteins operate in protein complexes, in which their close association modulates their function. However, with standard MS analysis, information on protein–protein interactions is lost and no structural information is retained. To gain structural and interactome data, new crosslinking reagents are needed that freeze inter‐ and intramolecular interactions. Herein, the development of a new reagent, which has several features that enable highly sensitive crosslinking MS, is reported. The reagent enables enrichment of crosslinked peptides from the majority of background peptides to facilitate efficient detection of low‐abundant crosslinked peptides. Due to the special cleavable properties, the reagent can be used for MS 2 and potentially for MS 3 experiments. Thus, the new crosslinking reagent, in combination with high‐end MS, should enable sensitive analysis of interactomes, which will help researchers to obtain important insights into cellular states in health and diseases.

Biochemistry & Molecular Biology↗

Trifluoromethylated Phenanthroline Ligands Reduce Excited-State Distortion in Homoleptic Copper(I) Complexes

Herein, we report the synthesis and excited-state dynamics for a series of homoleptic copper(I) trifluoromethylated phenanthroline complexes with two, three, and four trifluoromethyl functional groups. Our analysis of the steady-state absorbance and emission, transient-absorption spectroscopy, and electronic-structure-theory calculations results enable in-depth analysis of the pseudo-Jahn–Teller distortion inhibition from increased steric hindrance of the trifluoromethyl functional group relative to the prototypical dimethyl phenanthroline complex. Surprisingly, our results demonstrate that the greatest degree of pseudo-Jahn–Teller distortion inhibition is achieved with trifluoromethylation of only the 2 and 9 positions by an unusual combination of steric hindrance and stabilization of a nondistorted 1 MLCT manifold observed by transient kinetic lifetimes and optimized excited-state structures. The intersystem-crossing (ISC) lifetime for the 2,9-bis(trifluoromethyl)-1,10-phenanthroline Cu(I) complex is 69 ps, while the triplet excited-state lifetime and emission quantum yield are 106 ns and 4 × 10 –3 , respectively. Further trifluoromethylation of the phenanthroline yields a greater σ bond inductive withdrawing force on the phenanthroline nitrogens, ultimately resulting in weaker coordination to the copper. Last, the surprising success of the 2,9-bis(trifluoromethyl)-1,10-phenanthroline Cu(I) complex by adjusting both ligand sterics and electronic properties outlines a new strategy for developing long-lived Cu(I) charge-transfer complexes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

LINEBACKER: LINE-speed Bio-inspired Analysis and Characterization for Event Recognition

The cyber world is a complex domain, with digital systems mediating a wide spectrum of human and machine behaviors. While this is enabling a revolution in the way humans interact with each other and data, it also is exposing previously unreachable infrastructure to a worldwide set of actors. Existing solutions for intrusion detection and prevention that are signature-focused typically seek to detect anomalous and/or malicious activity for the sake of preventing or mitigating negative impacts. But a growing interest in behavior-based detection is driving new forms of analysis that move the emphasis from static indicators (e.g. rule-based alarms or tripwires) to behavioral indicators that accommodate a wider contextual perspective. Similar to cyber systems, biosystems have always existed in resource-constrained hostile environments where behaviors are tuned by context. So we look to biosystems as an inspiration for addressing behavior-based cyber challenges. In this paper, we introduce LINEBACKER, a behavior-model based approach to recognizing anomalous events in network traffic and present the design of this approach of bio-inspired and statistical models working in tandem to produce individualized alerting for a collection of systems. Preliminary results of these models operating on historic data are presented along with a plugin to support real-world cyber operations.

biosequence model↗

Binding orientation and interaction of bile salt in its ternary complex with pancreatic lipase-colipase system

Highlights: • Molecular dynamic simulation of porcine lipase-colipase with bile salt is performed. • Interactions between lipase-colipase and bile salt are analyzed. • Ternary complex is stabilized by van der Waals interactions. • Binding orientation of bile salt micelle on lipase-colipase is modelled. The interfacial activity of pancreatic lipases (PL) depends on the presence of colipase and bile salt. The activity of PL is inhibited by micellar concentrations of bile salt which can be restored by the addition of colipase. Though the formation of 1:1:1 tertiary complex by lipase-colipase-bile salt micelle is well accepted, the residue-level interactions between lipase-colipase and bile salt are yet to be clearly understood. Molecular dynamic simulations of lipase-colipase complex, lipase and colipase were performed in the presence of a model bile salt, sodium taurocholate (NaTC), at its near-CMC and supra-micellar concentrations. From the interactions obtained from the molecular dynamic simulations, the ternary complex was modelled and compared with earlier reports. The analysis suggested that a micelle of NaTC consisting of nine monomers was formed at the concave groove between lipase and colipase chain and it mainly interacted with the fourth finger of colipase. This complex was mainly stabilized by van der Waals interactions. Interestingly, the C-terminal domain of lipase which holds the colipase did not show any significant role in formation or stabilization of NaTC micelle.

60 APPLIED LIFE SCIENCES↗