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The detection and location capability of the International Monitoring System for small seismic events in the continental and oceanic regions surrounding the Sea of Japan is determined mainly by three primary seismic arrays: USRK, KSRS, and MJAR. Body wave arrivals are coherent on USRK and KSRS up to frequencies of around 4 Hz and classical array processing methods can detect and extract features for most regional signals on these stations. We demonstrate how empirical matched field processing (EMFP), a generalization of frequency-wavenumber or f-k analysis, can contribute to calibrated direction estimates which mitigate bias resulting from near-station geological structure. It does this by comparing the narrowband phase shifts between the signals on different sensors, observed at a given time, with corresponding measurements on signals from historical seismic events. The EMFP detection statistic is usually evaluated as a function of source location rather than slowness space and the size of the geographical footprint valid for EMFP templates is affected by array geometry, the availablesignal bandwidth, and Earth structure over the propagation path. The MJAR arrayhas similar dimensions to KSRS but is sited in far more complex geology which results in poor parameter estimates with classical f-k analysis for all signals lacking energy at 1 Hz or below. EMFP mitigates the signal incoherence to some degree but the geographical footprint valid for a given matched field template on MJAR is very small. Spectrogram beamforming provides a robust detection algorithm for high-frequency signals at MJAR. The array aperture is large enough that f-k analysis performed on continuous AR-AIC functions, calculated from optimally bandpass-filtered signals at the different sites, can provide robust slowness estimates for regional P-waves. Given a significantly higher SNR for regional S-phases on the horizontal components of the 3-component site of MJAR, we would expect incoherent detection and estimation of S-phases to improve with 3-component sensors at all sites. Given the diversity of the IMS stations, and the diversity of the methods which provide optimal results for a given station, we advocate the development of seismic processing pipelines which can process highly heterogeneous inputs to help associate characteristics of the incoming signals with physical events.

Introduction Non-injury-related factors have been extensively studied in major trauma and have been shown to have a significant impact on patient outcomes. Mental illness and associated medication use has been proven to have a negative effect on bone health and fracture healing. Materials and methods We collated data retrospectively from the records of orthopaedic inpatients in a non-COVID and COVID period. We analysed demographic data, referral and admission numbers, orthopaedic injuries, surgery performed and patient comorbidities, including psychiatric history. Results There were 824 orthopaedic referrals and 358 admissions (six/day) in the non-COVID period, with 38/358 (10.6%) admissions having a psychiatric diagnosis and 30/358 (8.4%) also having a fracture. This was compared with 473 referrals and 195 admissions (three/day) in the COVID period, with 73/195 (37.4%) admissions having a documented psychiatric diagnosis and 47/195 (24.1%) having a fracture. Discussion There was a reduction in the number of admissions and referrals during the pandemic, but a simultaneous three-fold rise in admissions with a psychiatric diagnosis. The proportion of patients with both a fracture and a psychiatric diagnosis more than doubled and the number of patients presenting due to a traumatic suicide attempt almost tripled. Conclusion While total numbers using the orthopaedic service decreased, the impact of the pandemic and lockdown disproportionately affects those with mental health problems, a group already at higher risk of poorer functional outcomes and non-union. It is imperative that adequate support is in place for patients with vulnerable mental health during these periods, particularly as we look towards a potential ‘second wave’ of COVID-19.

The presence of myocardial scar in CS patients results in poor prognosis and worse outcomes. 18F-fluorodeoxyglucose (18F-FDG) PET/CT excels at visualizing inflammation but is suboptimal at detecting scar. We evaluated PET/CT sensitivity to detect scar and investigated the incremental diagnostic value of automated PET-derived data. 176 patients who underwent cardiac magnetic resonance (CMR) and N-13 ammonia/18F-FDG cardiac PET/CT for suspected CS within 3 months were enrolled. Scar was defined as late gadolinium enhancement (LGE) on CMR without concordant 18F-FDG uptake on 18F-FDG PET/CT. Accuracy of cardiac PET/CT at detecting scar (perfusion defect without concordant 18F-FDG uptake) was assessed before and after addition of automated PET-derived data. Sensitivity of PET/CT for scar detection was 45.3% (specificity 88.9%). Addition of PET-derived LV volumes and function in a logistic regression model improved sensitivity to 57.0% (specificity: 80.0%, AUC 0.72). Addition of phase analysis maximum segmental onset of myocardial contraction > 61 improved AUC to 0.75, correctly relabeling 16.3% of patients as scar (net reclassification index 8.2%). Sensitivity of gated PET MPI alone for scar detection in CS is suboptimal. Adding PET-derived volumes/function and phase analysis data results in improved detection and characterization of scar.

Thermodynamic and kinetic properties of molecular adsorption and transport in metal-organic frameworks (MOFs) are crucially important for many applications, including gas adsorption, filtration, and remediation of harmful chemicals. Using the in situ 1H nuclear magnetic resonance (NMR) isotherm technique, we measured macroscopic thermodynamic and kinetic properties such as isotherms and rates of mass transfer while simultaneously obtaining microscopic information revealed by adsorbed molecules via NMR. Upon investigating isopropyl alcohol adsorption in MOF UiO-66 by in situ NMR, we obtained separate isotherms for molecules adsorbed at distinct environments exhibiting distinct NMR characteristics. A mechanistic view of the adsorption process is obtained by correlating such resolved isotherms with the cage structure effect on the nucleus-independent chemical shift, molecular dynamics such as the crowding effect at high loading levels, and the loading level dependence of the mass transfer rate as measured by NMR and elucidated by classical Monte Carlo simulations.

Large and small specimens of two species of metagenic Scyphozoa (true jellyfishes) can be found in nearshore waters off central Namibia throughout the year. Whereas populations of Chrysaora africana are largely restricted to inshore waters, C. fulgida occurs across the shelf, with small individuals found inshore and large individuals primarily found offshore. We examined stable isotopes δ15N and δ13C of both species in Walvis Bay and found that large-sized C. fulgida have lower δ15N values than small individuals and C. africana throughout the year. These differences are interpreted to reflect cross-shelf changes in δ15N baseline levels, with greater nitrogen recycling (and hence lower δ15N values) occurring offshore. The occasional/seasonal nearshore appearance of large C. fulgida with low δ15N values therefore implies routine, onshore advection. The values of δ13C did not show cross-shelf differences, which suggests that jellyfish populations across the shelf are supported by phytoplankton-based food chains. This study emphasises the value of using stable isotopes to examine the mesoscale structuring of jellyfish populations. Keywords: Chrysaora africana, coastal upwelling, eastern boundary currents, energy flow, jellyfish, metagenesis, molecular markers

Background & Aims Gastric dysfunction in the elderly may cause reduced food intake, frailty, and increased mortality. The pacemaker and neuromodulator cells interstitial cells of Cajal (ICC) decline with age in humans, and their loss contributes to gastric dysfunction in progeric klotho mice hypomorphic for the anti-aging Klotho protein. The mechanisms of ICC depletion remain unclear. Klotho attenuates Wnt (wingless-type MMTV integration site) signaling. Here, we examined whether unopposed Wnt signaling could underlie aging-associated ICC loss by up-regulating transformation related protein TRP53 in ICC stem cells (ICC-SC). Methods Mice aged 1–107 weeks, klotho mice, APCΔ468 mice with overactive Wnt signaling, mouse ICC-SC, and human gastric smooth muscles were studied by RNA sequencing, reverse transcription–polymerase chain reaction, immunoblots, immunofluorescence, histochemistry, flow cytometry, and methyltetrazolium, ethynyl/bromodeoxyuridine incorporation, and ex-vivo gastric compliance assays. Cells were manipulated pharmacologically and by gene overexpression and RNA interference. Results The klotho and aged mice showed similar ICC loss and impaired gastric compliance. ICC-SC decline preceded ICC depletion. Canonical Wnt signaling and TRP53 increased in gastric muscles of klotho and aged mice and middle-aged humans. Overstimulated canonical Wnt signaling increased DNA damage response and TRP53 and reduced ICC-SC self-renewal and gastric ICC. TRP53 induction persistently inhibited G1/S and G2/M cell cycle phase transitions without activating apoptosis, autophagy, cellular quiescence, or canonical markers/mediators of senescence. G1/S block reflected increased cyclin-dependent kinase inhibitor 1B and reduced cyclin D1 from reduced extracellular signal-regulated kinase activity. Conclusions Increased Wnt signaling causes age-related ICC loss by up-regulating TRP53, which induces persistent ICC-SC cell cycle arrest without up-regulating canonical senescence markers., Graphical abstract

Unlike the situation in most temperate systems, medusae of Chrysaora (in this case, Chrysaora fulgida) are present year-round off Namibia, in a variety of size classes, implying the year-round release of ephyrae. This hypothesis was investigated by studying temporal changes in ephyrae and other gelatinous zooplankton in Walvis Bay over a 2-year period (January 2012 to December 2013), using biweekly plankton samples. All 12 of the recovered taxa were characteristically neritic and included meroplanktonic Hydrozoa and Scyphozoa as well as cydippid ctenophores and shallow water siphonophores. While ephyrae of C. fulgida were dominant overall and peaked in abundance during mid-spring, they were not present all year round, being replaced (in part) by medusae of Obelia in autumn and by the siphonophore Muggiaea atlantica in mid-summer and mid-winter. The structure of the assemblages was driven primarily by bottom water temperature and day length (explaining 27.2% of the variability in community structure). The recruitment of ephyrae of C. fulgida to the plankton off Walvis Bay is not continuous throughout the year, and this challenges our understanding of the population dynamics of this species in the region.

Background The professional guidelines assume that the myocardial volume in systole (MVs) is equal to that in diastole (MVd), despite some limited evidence that points to the contrary. The aim of this manuscript is to determine whether this is true in healthy myocardium using gold standard cardiac MRI, as well as transthoracic echocardiography (TTE). The secondary aim is to determine whether there are similar MV changes in patients with heart failure with reduced ejection fraction (HFrEF). Method A prospectively derived cohort at Mayo Clinic of 115 adult subjects (mean age 42.8 years, 58% female) with no cardiac risk factors was identified. Cardiac MRI was obtained on all 115 patients, 51 of whom also consented to a TTE. MRI from a retrospectively derived cohort of 50 HFrEF patients was also collected. MVs and MVd was calculated using standard approaches with inclusion of the papillary muscles. Results In the healthy population, MRI demonstrated MVs/MVd = 0.87 (SD 0.04) and TTE demonstrated MVs/MVd = 0.79 (SD 0.07), suggesting compressibility (p Conclusion Contrary to currently accepted standards, healthy myocardium is compressible but HFrEF myocardium is incompressible. The ratio MVs/MVd merits further study in an expanded normal cohort and in disease states.

In this study, we show that the electrogenic Na+/HCO3− cotransporter, NBCe1/Slc4a4, is expressed in subtypes of interstitial cells of Cajal (ICCs) responsible for electrical slow wave generation throughout the mouse gastrointestinal tract and is absent in other types of ICCs. The transcripts of Slc4a4 expressed in mouse ICCs and human gastrointestinal smooth muscle are the regulated isoforms. This indicates a key role for HCO3- transport in generation of gastrointestinal motility patterns.

In patients with normal left ventricular ejection fraction, it may be difficult to distinguish between the normal and diseased heart. Novel assessments of ventricular function, such as extracellular volume imaging, myocardial perfusion imaging and myocardial contraction fraction are emerging to better assess disease burden in these cases. This study endeavored to determine whether the ratio of myocardial volume in systole to myocardial volume in diastole (MVs/MVd), differs between normal hearts and those with disease states characterized by normal ejection fraction.Consecutive patients from 2008 to 2018 with hypertrophic cardiomyopathy (HCM), cardiac amyloidosis, and heart failure with preserved ejection fraction (HFpEF) who underwent cardiac magnetic resonance imaging (MRI) were selected for inclusion, along with a sex- and age-matched cohort of normal volunteers who also underwent cardiac MRI. Manual tracings were performed on each MRI to calculate MVs/MVd, which was then compared across subgroups.Included were 50 patients with HCM, 50 patients with cardiac amyloidosis, 26 patients with HFpEF, and 30 normal subjects. Age was 54.1 years (SD 16.7); mean MVs/MVd was 0.88 (SD 0.04) in the normal subgroup, 1.03 (SD 0.06) in HCM patients, 1.03 (SD 0.06) in cardiac amyloidosis patients, and 0.97 (SD 0.02) in HFpEF patients, with all pathology subgroups different from the normal subgroup (p .0001 for each). The ratio of MVs/MVd discriminated diseased from normal with c statistic 0.989 (p .001).This study suggests that a novel and easily-captured metric of ventricular function, MVs/MVd, can differentiate normal ventricular function from multiple cardiomyopathies with normal ejection fractions.

The Izak catshark Holohalaelurus regani and the yellow-spotted catshark Scyliorhinus capensis both occur over the continental shelf around South Africa and are often caught together as bycatch in d...

Effect of Na non-stoichiometry in Sr(Hf0.5Zr0.5)O3-modified Bi0.5(Na(0.8+x)K0.2)0.5TiO3 ceramics was examined in the range of − 0.04 ≤ x ≤ 0.04. The effect of Na non-stoichiometry on microstructure, ferroelectric, piezoelectric, dielectric properties and high-temperature impedance was explored. Compared to the stoichiometric compositions, Na excess and deficiency exhibit the same effect as observed for the acceptor and donor doping, respectively. All non-stoichiometric and stoichiometric compositions exhibit a pure ABO3 perovskite phase with pseudocubic symmetry. The deficiency of Na in ceramics decreases the grain size and drives the system towards ergodic relaxor as evident by pinched ferroelectric loop and the negligible negative strain along with an increase in maximum strain (Sm). The corresponding normalized strain (Sm/Emax.) increased from 275 to 800 pm/V when Na content decreased from x = + 0.04 to − 0.04. In contrast, excess Na exhibits the converse effect and drives the system towards ferroelectricity. Composition with deficient Na also exhibits lower dielectric loss and increase in resistivity by an order of magnitude compared to excess Na as observed from the high-temperature dielectric and impedance measurements. The results of this study demonstrate that Na non-stoichiometry significantly affects the electric properties of the studied system and thus can be effectively modulated to achieve improved electromechanical properties for materials having actuator-based applications.

Temporary transfers of firearms from suicidal persons is a strategy to reduce the incidence of suicide deaths. We discuss a barrier to the effective operation of voluntary temporary firearm transfer laws: the dearth of guidance on the liability for returning firearms to persons who voluntarily surrender them. We examine the laws of all 50 US states that regulate temporary surrenders of firearms and evaluate whether any provisions govern liability for returning temporarily surrendered firearms. Although 14 states create background check exceptions to permit temporary transfers of firearms from an owner to family, friends, retailers, or law enforcement, no states prescribe procedures for returning those firearms.ability for returning the firearms to people who voluntarily surrendered them. We recommend amending state laws to clarify the process and liability for returning temporarily surrendered firearms to the original owner. Such amendments would be intended to mitigate the potential chilling effect that lack of clarity and presumption of liability may impose on efficiently reducing firearm access to protect firearm owners at risk for suicide.

The zoogeography of marine Bryozoa around South Africa was investigated using published distribution records, museum catalogues, and an examination of previously unworked bryozoan material in (most...

Nanorods of PCN-222, a large-pore, zirconium-based porphyrinic metal-organic framework (MOF), have been prepared through coordination modulation-controlled crystal growth through competing monodentate ligands known as modulators-for incorporation into reverse osmosis thin-film nanocomposite (TFN) membranes. Postsynthetic modification of the MOF node through binding of myristic acid (MA) altered channel dimensions and pore size distribution. The extent of MOF modification was characterized through Brunauer-Emmett-Teller gas sorption and 1H NMR following digestion of the particles. TFN membranes containing PCN-222 nanoparticles modified with varying levels of MA were fabricated via dispersion in the aqueous phase during interfacial polymerization, and the resulting flux and rejection performance of each membrane were evaluated. Increased water flux was observed with increasing MA content in the PCN-222 nanorods. Up to 95% increase in water flux was observed for a TFN containing 0.01 wt % loading of PCN-222 nanorods with a 10:1 MA to linker ratio, while maintaining high salt rejection. The flux change was attributed to tunable water transport through the nanorod pore structure and also through rapid water transport pathways at the nanorod-polymer interface.

Objective To evaluate the use of stress testing in a community population with de novo stable chest pain, a normal resting electrocardiogram (ECG), and the ability to exercise. Patients and Methods We identified eligible patients by searching the electronic medical record of all outpatients seen at Mayo Clinic Rochester from January 1, 2010, through December 31, 2013. We determined the frequency of initial exercise stress testing, computed tomography coronary angiography, and invasive coronary angiography, as well as the use of subsequent second procedures (including percutaneous coronary intervention [PCI] and coronary artery bypass grafting) within 90 days. Patients were followed for 5 years for death, nonfatal myocardial infarction, and hospitalization for unstable angina. Results The data search identified 1175 patients with chest pain and normal resting ECGs. Only 331 patients underwent cardiac testing. A slight majority (185; 55.9%) underwent an exercise ECG alone. The remainder underwent exercise echocardiography (112; 33.8%), exercise single-photon–emission computed tomography (32; 9.7%), or computed tomography coronary angiography (2; 0.9%). Few patients (30; 9.1%) required additional testing within 90 days. Of the 14 patients (4.2%) who underwent invasive coronary angiography, 12 (85.7%) had significant coronary artery disease, and were referred for percutaneous coronary intervention or coronary artery bypass grafting. At 5 years, the mortality rate was 1.2%, and the combined event rate was 3.8%. Conclusion Most community patients with chest pain and a normal resting ECG do not require further cardiac evaluation. In patients who require testing, and are able to exercise, noninvasive stress testing is preferred. Invasive coronary angiography is applied selectively and associated with a high rate of significant coronary artery disease and referral to coronary revascularization. Long-term outcomes are excellent.

The Mw 4.5 southern Viking graben earthquake on 30 June 2017 was one of the largest seismic events in the Norwegian part of the North Sea during the last century. It was well recorded on surrounding broadband seismic stations at regional distances, and it generated high signal-to-noise ratio teleseismic P arrivals at up to 90° with good azimuthal coverage. Here, the teleseismic signals provide a unique opportunity to constrain the event hypocenter. Depth phases are visible globally and indicate a surface reflection in the P-wave coda some 4 s after the initial P arrival, giving a much better depth constraint than regional S-P time differences provide. Moment tensor inversion results in a reverse thrust faulting mechanism. The fit between synthetic and observed surface waves at regional distances is improved by including a sedimentary layer. Synthetic teleseismic waveforms generated based on the moment tensor solution, and a near-source 1D velocity model indicates a depth of 7 km. Correlation detectors using the S-wave coda from the main event were run on almost 30 yr of continuous multichannel seismic data searching for repeating signals. In addition to a magnitude 1.9 aftershock 33 min later, and a few magnitude ∼1 events in the following days, a magnitude 2.5 earthquake on 13 November 2016 was the only event found to match the 30 June 2017 event well. Using double-difference techniques, we find that the two largest events are located within 1 km of the main event. We present a Bayesloc probabilistic multiple event location including the 30 June event and all additional seismic events in the region well recorded on the regional networks. The Bayesloc relocation gave a more consistent seismicity pattern and moved several of the events more toward the west. The results of this study are also discussed within the regional seismotectonic frame of reference.

Between 2014 and 2017, almost 200 new seismic stations were installed in Alaska and northwestern Canada as part of the EarthScope USArray Transportable Array. These stations currently provide an unprecedented capability for the detection and location of seismic events in regions with otherwise relatively sparse station coverage. Two interesting earthquake sequences in 2018 and 2019 in the northeastern Brooks Range were exceptionally well recorded because of this deployment. First is the aftershock sequence of the Mw 6.4 and Mw 6.0 Kaktovik earthquakes of 12 August 2018, the largest earthquakes recorded to date in the region. The second is the Niviak swarm, southwest of the Kaktovik sequence. Since July 2018, >4000 earthquakes between magnitudes 1 and 4.3 have been recorded across a region exceeding 5000 km2. We explore how the Bayesloc probabilistic multiple seismic-event location algorithm can better resolve features of these two sequences, exploiting the large numbers of readings that the improved station coverage provides from events down to magnitudes below 2. The Bayesloc calculations consistently move events in the Kaktovik sequence a few kilometers to the northeast, providing an almost linear east-southeast-striking southern limit to the aftershock zone. Analysis of the Bayesloc joint probability distribution of corrections to travel-time predictions indicate that anomalously fast wave propagation to the southwest is likely the most significant contribution to the seismic-event mislocation. The joint relocations are more consistent with Interferometric Synthetic Aperture Radar–inferred coseismic displacement than the network location estimates. The Bayesloc relocation of the Niviak events confirms that the earthquakes are distributed between many distinct clusters of seismicity that have clearer spatial separation following the relocation. The probabilistic relocations motivate both double-difference studies to better resolve clustered seismicity at the smallest spatial scales and systematic multiple event relocation studies to calculate structure and travel-time corrections over larger scales.

In seismically active regions with variable dominant focal mechanisms, there is considerable tsunami inundation height uncertainty. Basic earthquake source parameters such as dip, strike, and rake affect significantly the tsunamigenic potential and the tsunami directivity. Tsunami inundation is also sensitive to other properties such as bottom friction. Despite their importance, sensitivity to these basic parameters is surprisingly sparsely studied in literature. We perform suites of systematic parameter searches to investigate the sensitivity of inundation at the towns of Catania and Siracusa on Sicily to changes both in the earthquake source parameters and the Manning friction. The inundation is modelled using the Tsunami-HySEA shallow water code on a system of nested topo-bathymetric grids with a finest spatial resolution of 10 m. This GPU-based model, with significant HPC resources, allows us to perform large numbers of high-resolution tsunami simulations. We analyze the variability of different hydrodynamic parameters due to large earthquakes with uniform slip at different locations, focal depth, and different source parameters. We consider sources both near the coastline, in which significant near-shore co-seismic deformation occurs, and offshore, where near-shore co-seismic deformation is negligible. For distant offshore earthquake sources, we see systematic and intuitive changes in the inundation with changes in strike, dip, rake, and depth. For near-shore sources, the dependency is far more complicated and co-determined by both the source mechanisms and the coastal morphology. The sensitivity studies provide directions on how to resolve the source discretization to optimize the number of sources in Probabilistic Tsunami Hazard Analysis, and they demonstrate a need for a far finer discretization of local sources than for more distant sources. For a small number of earthquake sources, we study systematically the inundation as a function of the Manning coefficient. The sensitivity of the inundation to this parameter varies greatly for different earthquake sources and topo-bathymetry at the coastline of interest. The friction greatly affects the velocities and momentum flux and to a lesser but still significant extent the inundation distance from the coastline. An understanding of all these dependencies is needed to better quantify the hazard when source complexity increases.

The conformational dependence of the matrix element for spin–orbit coupling and of the electronic coupling for charge separation are determined for an electron donor–acceptor system containing a pyrene acceptor and a dimethylaniline donor. Different kinetic and energetic aspects that play a role in the spin–orbit charge transfer intersystem crossing (SOCT-ISC) mechanism are discussed. This includes parameters related to initial charge separation and the charge recombination pathways using the Classical Marcus Theory of electron transfer. The spin–orbit coupling, which plays a significant role in charge recombination to the triplet state, can be probed by (TD)-DFT, using the latter as a tool to understand and predict the SOCT-ISC mechanism. The matrix elements for spin–orbit coupling for acetone and 4-thio-thymine are used for benchmarking. (Time Dependent-) Density Functional Theory (DFT and TD-DFT) calculations are applied using the quantum chemical program Amsterdam Density Functional (ADF).

The use of a single component porphyrin thin-film for photodynamic antimicrobial chemotherapy is unexplored. Herein, a porphyrin with good film formation properties is used to make thin layers, by physical vapor phase deposition, that are stable in aqueous media and can generate singlet oxygen upon 650 nm excitation. The synthesis and photophysical studies, in solution and as thin film, of free base 5,10,15,20-tetra-(4-hexyloxyphenyl)porphyrin are described. The porphyrin was synthesized via modified Adler-Longo conditions. Thin films of this porphyrin were made on quartz glass via spin coating and via vapour-phase deposition. The porphyrin was studied, in solution and as thin film (without a polymer component or matrix), with UV-Vis spectroscopy and with steady-state and time-resolved photoluminescence spectroscopy. The spin coated films display sharp J-band emission at 741 nm, indicating J-aggregate formation, but are not stable in aqueous media. The thin films obtained via vapour-phase deposition do not show the J-band emission, but are stable. The detection of singlet oxygen generated by the porphyrin thin film using a chemiluminescent water-soluble singlet oxygen probe is reported.

The conformational dependence of the matrix element for spin-orbit coupling and of the electronic coupling for charge separation are determined for an electron donor-acceptor system containing a pyrene acceptor and a dimethylaniline donor. Different kinetic and energetic aspects that play a role in the spin-orbit charge transfer intersystem crossing (SOCT-ISC) mechanism are discussed. This includes parameters related to initial charge separation and the charge recombination pathways using the (Semi-Classical) Marcus Theory for electron transfer. The spin-orbit coupling, which plays a significant role in charge recombination to the triplet state can be probed by (TD-)DFT, using the latter as a tool to understand and predict the SOCT-ISC mechanism. The matrix elements for spin-orbit coupling for acetone and 4-thio-thymine are used for benchmarking. (Time Dependent-) Density Functional Theory (DFT and TD-DFT) calculations are applied using the quantum chemical program Amsterdam Density Functional (ADF).

Defect engineering in metal-organic frameworks (MOFs) has recently become an area of significant research due to the possibility of enhancing material properties such as internal surface area and catalytic activity while maintaining stable 3D structures. Through a modulator screening study, the model Zr4+ MOF, UiO-66, has been synthesized with control of particle sizes (100-1900 nm) and defect levels (2-24%). By relating these properties, two series were identified where one property remained constant, allowing for independent analysis of the defect level or particle size, which frequently change coincident with the modulator choice. The series were used to compare UiO-66 reactivity for the hydrolysis of a chemical warfare agent simulant, dimethyl 4-nitrophenylphosphate (DMNP). The rate of DMNP hydrolysis displayed high dependence on the external surface area, supporting a reaction dominated by surface interactions. Moderate to high concentrations of defects (14-24%) allow for the accessibility of some interior MOF nodes but do not substantially promote diffusion into the framework. Individual control of defect levels and particle sizes through modulator selection may provide useful materials for small molecular catalysis and provide a roadmap for similar engineering of other zirconium frameworks.

Biodiversity informatics is a new and evolving field, requiring efforts to develop capacity and a curriculum for this field of science. The main objective was to summarise the level of activity and the efforts towards developing biodiversity informatics curricula, for work-based training and/or academic teaching at universities, taking place within the Global Biodiversity Information Facility (GBIF) countries and its associated network. A survey approach was used to identify existing capacities and resources within the network. Most of GBIF Nodes survey respondents (80%) are engaged in onsite training activities, with a focus on work-based professionals, mostly researchers, policy-makers and students. Training topics include data mobilisation, digitisation, management, publishing, analysis and use, to enable the accessibility of analogue and digital biological data that currently reside as scattered datasets. An initial assessment of academic teaching activities highlighted that countries in most regions, to varying degrees, were already engaged in the conceptualisation, development and/or implementation of formal academic programmes in biodiversity informatics, including programmes in Benin, Colombia, Costa Rica, Finland, France, India, Norway, South Africa, Sweden, Taiwan and Togo. Digital e-learning platforms were an important tool to help build capacity in many countries. In terms of the potential in the Nodes network, 60% expressed willingness to be recruited or commissioned for capacity enhancement purposes. Contributions and activities of various country nodes across the network have been highlighted and a working curriculum framework has been defined.

Abstract Phase pure perovskite (1-x)Bi1/2Na1/2TiO3 – xBi1/2K1/2TiO3 (BNKT) thin films were successfully prepared via an inverse mixing order chemical solution deposition method and the impact of process conditions on film properties were observed. Process conditions evaluated included crystallization temperature and time, ramp rate, pyrolysis temperature, and cation excess. Properties measured included crystal structure, dielectric constant, dielectric loss, piezoelectric response, and ferroelectric response. A few notable trends were observed. A subtle impact on piezoelectric response was observed in films prepared using different ramp rates: 100 C per second films (d33,f = 60 ± 5 pm/V at 1 kHz), 75 °C per second films (d33,f = 55 ± 5 pm/V) and 150 C per second films (d33,f = 50 ± 5 pm/V). Films prepared using a 75 °C per second ramp rate displayed slightly higher dielectric loss (tan δ = 0.09 at 1 kHz) than films prepared using a 100 °C per second ramp rate (tan δ = 0.07 at 1 kHz) or 150 °C per second ramp rate (tan δ = 0.05 at 1 kHz). Pyrolysis temperatures greater than 350 °C are necessary to burn off organics and maximize film dielectric constant. Dielectric constant increased from 450 ± 50 at 1 kHz to 600 ± 50 at 1 kHz by increasing pyrolysis temperature from 300 to 400 °C. Excess cation amounts (for compositional control) were also evaluated and it was found films with higher amounts of Na and K excess compared to bismuth excess displayed an increase in d33,f of about 10 pm/V compared to films prepared with equivalent Bi and Na and K excess amounts. Article highlights Impact of processing conditions on inverse mixing order chemical solution deposited bismuth based thin films. Dielectric, piezoelectric, and ferroelectric properties of thin film bismuth sodium titanate-bismuth potassium titanate thin films. Developing lead-free piezoelectric actuator materials.

The design and performance of a new Compton-suppressed HPGe and charged-particle array, CLARION2-TRINITY, are described. The TRINITY charged-particle array is comprised of 64 Cerium-doped Gadolinium Aluminium Gallium Garnet (GAGG:Ce) crystals configured into five rings spanning 7-54 degrees, and two annular silicon detectors that can shadow or extend the angular coverage to backward angles with minimal $\gamma$-ray attenuation. GAGG:Ce is a non-hygroscopic, bright, and relatively fast scintillator with a light distribution well matched to SiPMs. Count rates up to 40 kHz per crystal are sustainable. Fundamental characteristics of GAGG:Ce are measured and presented, including light- and heavy-ion particle identification (PID) capability, pulse-height defects, radiation hardness, and emission spectra. The CLARION2 array consists of up to 16 Compton-suppressed HPGe Clover detectors ($\approx4\%$ efficiency at 1 MeV) configured into four rings (eight HPGe crystal rings) using a non-Archimedean geometry that suppresses back-to-back coincident 511-keV gamma rays. The entire array is instrumented with 100- and 500-MHz (14 bit) waveform digitizers which enable triggerless operation, pulse-shape discrimination, fast timing, and pileup correction. Finally, two examples of experimental data taken during the commissioning of the CLARION2-TRINITY system are given: a PID spectrum from $^{16}$O + $^{18}$O fusion-evaporation, and PID and Doppler-corrected $\gamma$-ray spectra from $^{48}$Ti + $^{12}$C Coulomb excitation., Comment: 14 pages, 21 figures

The high seas—marine areas beyond national jurisdiction (1)—cover nearly half of Earth's surface (2). The high seas support our planet in countless ways, from regulating the climate, to feeding millions of people, to supporting industries that contribute billions of dollars to the global economy (3). Even so, less than 1% of the high seas are fully protected (4), and the current patchwork of management and lack of oversight leaves them vulnerable to abuse. In 2017, the United Nations resolved to develop an international treaty for the conservation and sustainable use of the high seas. Negotiations are set to end this year. We must ensure that the forthcoming framework conserves high-seas biodiversity and promotes sustainable and equitable use.

The aspect ratio (AR) of filler particles is one of the most critical determinants for the mechanical properties of particle-reinforced polymer composites. However, it has been challenging to solely study the effect of particle AR due to the difficulties of controlling AR without altering the physical and chemical properties of the particle. Herein, we synthesized PCN-222, a zirconium-based porphyrinic metal-organic framework (MOF) with preferential longitudinal growth as a series of particles with ARs increasing from 3.4 to 54. The synthetic MOF conditions allowed for the chemical properties of the particles to remain constant over the series. The particles were employed as reinforcers for poly(methyl methacrylate) (PMMA). MOF-polymer composite films were fabricated using doctor-blading techniques, which facilitated particle dispersion and alignment in the PMMA matrix, as revealed by optical microscopy and wide-angle X-ray diffraction. Mechanical measurements showed that both elastic and dynamic moduli increased with particle AR and particle concentrations but started to decrease as particle loading increased beyond 0.5 wt % (1.12 vol %). The data obtained at low particle loadings were fitted well with the Halpin-Tsai model. In contrast, the percolation model and the Cox model were unable to adequately fit the data, indicating the mechanical reinforcement in our system mainly originated from efficient load transfer between particles and the matrix in the particle orienting direction. Finally, we showed that the thermal stability of composite films increased with the addition of MOF particles because of the high thermal degradation temperature and restricted polymer chain mobility.

ObjectiveThis study was designed to evaluate the roles of microRNAs (miRNAs) in slow transit constipation (STC).DesignAll human tissue samples were from the muscularis externa of the colon. Expression of 372 miRNAs was examined in a discovery cohort of four patients with STC versus three age/sex-matched controls by a quantitative PCR array. Upregulated miRNAs were examined by quantitative reverse transcription qPCR (RT-qPCR) in a validation cohort of seven patients with STC and age/sex-matched controls. The effect of a highly differentially expressed miRNA on a custom human smooth muscle cell line was examined in vitro by RT-qPCR, electrophysiology, traction force microscopy, and ex vivo by lentiviral transduction in rat muscularis externa organotypic cultures.ResultsThe expression of 13 miRNAs was increased in STC samples. Of those miRNAs, four were predicted to target SCN5A, the gene that encodes the Na+ channel NaV1.5. The expression of SCN5A mRNA was decreased in STC samples. Let-7f significantly decreased Na+ current density in vitro in human smooth muscle cells. In rat muscularis externa organotypic cultures, overexpression of let-7f resulted in reduced frequency and amplitude of contraction.ConclusionsA small group of miRNAs is upregulated in STC, and many of these miRNAs target the SCN5A-encoded Na+ channel NaV1.5. Within this set, a novel NaV1.5 regulator, let-7f, resulted in decreased NaV1.5 expression, current density and reduced motility of GI smooth muscle. These results suggest NaV1.5 and miRNAs as novel diagnostic and potential therapeutic targets in STC.

Background Service users and carers using mental health services want more involvement in their care and the aim of this research programme was to enhance service user and carer involvement in care planning in mental health services. Objectives Co-develop and co-deliver a training intervention for health professionals in community mental health teams, which aimed to enhance service user and carer involvement in care planning. Develop a patient-reported outcome measure of service user involvement in care planning, design an audit tool and assess individual preferences for key aspects of care planning involvement. Evaluate the clinical effectiveness and the cost-effectiveness of the training. Understand the barriers to and facilitators of implementing service user- and carer-involved care planning. Disseminate resources to stakeholders. Methods A systematic review, focus groups and interviews with service users/carers/health professionals informed the training and determined the priorities underpinning involvement in care planning. Data from focus groups and interviews were combined and analysed using framework analysis. The results of the systematic review, focus groups/interviews and a review of the training interventions were synthesised to develop the final training intervention. To develop and validate the patient-reported outcome measure, items were generated from focus groups and interviews, and a psychometric analysis was conducted. Patient-reported outcome measure items and a three-round consensus exercise were used to develop an audit tool, and a stated preference survey was undertaken to assess individual preferences for key aspects of care planning. The clinical effectiveness and cost-effectiveness of the training were evaluated using a pragmatic cluster trial with cohort and cross-sectional samples. A nested longitudinal qualitative process evaluation using multiple methods, including semistructured interviews with key informants involved locally and nationally in mental health policy, practice and research, was undertaken. A mapping exercise was used to determine current practice, and semistructured interviews were undertaken with service users and mental health professionals from both the usual-care and the intervention arms of the trial at three time points (i.e. baseline and 6 months and 12 months post intervention). Results The results from focus groups (n = 56) and interviews (n = 74) highlighted a need to deliver training to increase the quality of care planning and a training intervention was developed. We recruited 402 participants to develop the final 14-item patient-reported outcome measure and a six-item audit tool. We recruited 232 participants for the stated preference survey and found that preferences were strongest for the attribute ‘my preferences for care are included in the care plan’. The training was delivered to 304 care co-ordinators working in community mental health teams across 10 NHS trusts. The cluster trial and cross-sectional survey recruited 1286 service users and 90 carers, and the primary outcome was the Health Care Climate Questionnaire. Training was positively evaluated. The results showed no statistically significant difference on the primary outcome (the Health Care Climate Questionnaire) (adjusted mean difference –0.064, 95% confidence interval –0.343 to 0.215; p = 0.654) or secondary outcomes at the 6-month follow-up. Overall, the training intervention was associated with a net saving of –£54.00 (95% confidence interval –£193.00 to £84.00), with a net quality-adjusted life-year loss of –0.014 (95% confidence interval –0.034 to 0.005). The longitudinal process evaluation recruited 54 service users, professionals and carers, finding a failure of training to become embedded in routine care. Limitations Our pragmatic study was designed to improve service user and care involvement in care planning among routine community mental health services. We intervened in 18 sites with > 300 care co-ordinators. However, our volunteer sites may not be fully representative of the wider population, and we lacked data with which to compare our participants with the eligible population. Conclusions We co-developed and co-delivered a training intervention and developed a unidimensional measure of service user and carer involvement in care planning and an audit tool. Despite a high level of satisfaction with the training, no significant effect was found; therefore, the intervention was ineffective. There was a failure of training to become embedded and normalised because of a lack of organisational readiness to accept change. Working with NHS trusts in our ‘Willing Adopters’ programme with enhanced organisational buy-in yielded some promising results. Future work Research should focus on developing and evaluating new organisational initiatives in addition to training health-care professionals to address contextual barriers to service and carer involvement in care planning, and explore co-designing and delivering new ways of enhancing service users’ and carers’ capabilities to engage in care planning. Trial registration Current Controlled Trials ISRCTN16488358. Funding This project was funded by the National Institute for Health Research (NIHR) Programme Grants for Applied Research programme and will be published in full in Programme Grants for Applied Research; Vol. 7, No. 9. See the NIHR Journals Library website for further project information.

Key Points Leukemic blasts of a female carrier of an ATRX germline mutation have persistently skewed inactivation of the X chromosome. Germline mutation in leukemia needs to be interpreted with caution because it is not always pathologic.

Postsurgical gastric dysfunction is common, but the mechanisms are varied and poorly understood. The pylorus normally acts as an electrical barrier isolating gastric and intestinal slow waves. In this report, we present an aberrant electrical conduction pathway arising between the stomach and small intestine, following pyloric excision and surgical anastomosis, as a novel disease mechanism. A patient was referred with postsurgical gastroparesis following antrectomy, gastroduodenostomy, and vagotomy for peptic ulceration. Scintigraphy confirmed markedly abnormal 4-h gastric retention. Symptoms included nausea, vomiting, postprandial distress, and reflux. Intraoperative, high-resolution electrical mapping was performed across the anastomosis immediately before revision gastrectomy, and the resected anastomosis underwent immunohistochemistry for interstitial cells of Cajal. Mapping revealed continuous, stable abnormal retrograde slow-wave propagation through the anastomosis, with slow conduction occurring at the scar (4.0 ± 0.1 cycles/min; 2.5 ± 0.6 mm/s; 0.26 ± 0.15 mV). Stable abnormal retrograde propagation continued into the gastric corpus with tachygastria (3.9 ± 0.2 cycles/min; 1.6 ± 0.5 mm/s; 0.19 ± 0.12 mV). Histology confirmed ingrowth of atypical ICC through the scar, defining an aberrant pathway enabling transanastomotic electrical conduction. In conclusion, a “gastrointestinal aberrant pathway” is presented as a novel proposed cause of postsurgical gastric dysfunction. The importance of aberrant anastomotic conduction in acute and long-term surgical recovery warrants further investigation. NEW & NOTEWORTHY High-resolution gastric electrical mapping was performed during revisional surgery in a patient with severe gastric dysfunction following antrectomy and gastroduodenostomy. The results revealed continuous propagation of slow waves from the duodenum to the stomach, through the old anastomotic scar, and resulting in retrograde-propagating tachygastria. Histology showed atypical interstitial cells of Cajal growth through the anastomotic scar. Based on these results, we propose a “gastrointestinal aberrant pathway” as a mechanism for postsurgical gastric dysfunction.

Aluminum alloy 6061 is commonly used as fuel cladding in nuclear research and test reactors. Over time, this cladding will oxidize and reduce heat transfer from the fuel to the reactor pool, which is a safety concern. Previous oxide growth predictions for these reactors are based on correlations developed from data taken at higher temperatures and pressures and may be overly conservative. This work assesses the validity of three existing oxide growth rate correlations at lower temperatures and pressures by measuring the oxide thickness formed over six months of exposure to water. In addition, we compare the corrosion rate of the as-received samples to the prefilmed samples that have a thin boehmite layer in order to assess the benefit of this surface modification. Samples were analyzed by scanning electron microscopy, energy dispersive spectroscopy, and X-ray diffraction to characterize the oxide thickness, chemistry, and crystal structure, respectively. Open-circuit potential monitoring, electrochemical impedance spectroscopy, linear polarization resistance, and cyclic voltammetry were used to study corrosion resistance. Results show that the boehmite on the prefilmed samples is a stable, protective phase under the conditions tested. The non-prefilmed samples produced a partially crystalline unprotective oxide, with a linear rate of oxide growth. The prefilming process is deemed necessary for fuel cladding applications, and two of the three correlations considered herein conservatively predicted the oxide thickness of the prefilmed samples.

Background Botulinum toxin (Botox) has long been used therapeutically to treat a variety of diseases, including migraine headaches, cervical spine dystonia, and chronic cervical spine pain, among many others. Although quite useful, Botox has been reported to cause adverse events, some of which may lead to devastating morbidity. Case Description An elderly woman presented with severe neck pain after a motor vehicle collision. She underwent Botox administration to the neck extensor muscles, after which she developed severe cervical kyphotic deformity, a complication previously reported only in patients with a history of cervical fusion. In addition, the patient had a pre-existing cervical spine degenerative disc disease with listhesis resulting in cervical kyphotic deformity and loss of cervical lordosis. Conclusions This case illustrates a potential danger of using Botox in the neck of an elderly patient who may have pre-existing cervical spine instability, underlying cervical musculature weakness, and pre-existing cervical kyphosis. It demonstrates the need to evaluate patients who are predisposed to developing cervical kyphotic deformities before offering them Botox treatment.

The Ca2+-activated Cl- channel, anoctamin 1 (Ano1, also known as transmembrane protein 16A) contributes to intestinal pacemaking, fluid secretion, cellular excitability, and tissue development. The human ANO1 promoter contains binding sites for the glioma-associated oncogene (Gli) proteins. We investigated regulation of ANO1 transcription by Gli. ANO1 promoter activity was determined using a luciferase reporter system. Binding and functional effects of Glis on ANO1 transcription and expression were demonstrated by chromatin immunoprecipitation, small interfering RNA knockdown, PCR, immunolabeling, and recordings of Ca2+-activated Cl- currents in human embryonic kidney 293 (HEK293) cells. Results from previous genome-wide association studies were used to test ANO1 promoter polymorphisms for association with disease. Gli1 and Gli2 bound to the promoter and repressed ANO1 transcription. Repression depended on Gli binding to a site close to the ANO1 transcriptional start site. Mutation of this site prevented Gli binding and transcriptional repression. Knockdown of Gli expression and inhibition of Gli activity increased expression of ANO1 RNA and Ca2+-activated Cl- currents in HEK293 cells. A single-nucleotide polymorphism prevented Gli binding and showed association with irritable bowel syndrome. We conclude that Gli1 and Gli2 repress ANO1 by a novel mechanism that is independent of Gli cleavage and that has a role in gastrointestinal function.-Mazzone, A., Gibbons, S. J., Eisenman, S. T., Strege, P. R., Zheng, T., D'Amato, M., Ordog, T., Fernandez-Zapico, M. E., Farrugia, G. Direct repression of anoctamin 1 (ANO1) gene transcription by Gli proteins.

The basic biology and ecology of the South African east coast round herring Etrumeus wongratanai was investigated from samples of fish collected between 2013 and 2016. This species is short-lived and reaches a maximum of 3 years of age, with rapid growth in its first year of life. It reproduces from June to December (austral summer) and condition factor was lowest in May through to August and increased from September, probably reflecting the physiological strain before and during spawning. Fish larvae were the most important food items consumed during summer, whereas eucalanid copepods were the most important prey at other times of the year. Stable-isotope data suggest that there are gradual changes in the trophic level with increasing fish size, δ15 N and δ13 C values also differed between seasons. The results obtained here are compared with those of other Etrumeus species, regionally and globally.

In September 2014, the ARCES array in Northern Norway was upgraded to consist of 3-component instruments at each of its 25 sites. It is thereby the first array station of the International Monitoring System to be fully 3-component. S-phases are of paramount importance for the detection and location of seismic events at regional distances, especially given sparse station coverage, and it is important that these phases are both detected confidently and attributed accurate slowness estimates. The slowness estimates both identify the phase and provide phase association algorithms with the information necessary to form a high-quality seismic event hypothesis. Prior to September 2014, ARCES had 3-component sensors at four sites only. While these 3-component seismometers were highly beneficial for the detection of regional S-phases, often using incoherent beams, it was often more reliable to perform f-k analysis on the 25 vertical sensors rather than the small number of available horizontal waveforms. In addition to providing an increased signal-to-noise ratio, signals on the horizontal traces are more coherent for the S-phases and display a high measure of semblance over the array. This improves the stability of f-k analysis, since the estimates are less susceptible to the effects of scattering and incoherence. The improved coherence of S-phases across the array aperture on the horizontal components provides the basis for superior secondary phase detection capability using F-detectors and other coherence-based algorithms. Analysis of regional signal coda on the 3-component array indicates different characteristics of the apparent slowness on the different components. The 27 January 2018 earthquake on Novaya Zemlya was the first seismic event close to the former Soviet nuclear test-site to be recorded using the upgraded 3-component ARCES array. We examine the evolution of the slowness pattern for on the different components of the wavetrain and speculate that a continuous f-k detector on three components may be able to detect small seismic events in the eastern Barents Sea with increased robustness and sensitivity. We review the development of the instrumentation at ARCES and explain the motivation behind the hybrid response sensors currently deployed.