They allegedly took part in a failed bid to topple Maduro

RT-PCR test not must to discharge mild cases

Covid-19: Centre eases discharge rule, BMC scraps strict test order

'Mild cases can be discharged without test'

From now on, only those with severe Covid-19 symptoms will need to undergo RT-PCR tests, that too only one and not two consecutive tests that were mandatory earlier, for their release from the hospital after treatment. Covid-positive patients with mild and moderate symptoms will no longer require the mandatory negative confirmatory tests before they are sent home.

‘Earlier, he tested negative thrice’

A total of 23 people who recovered from COVID-19 were discharged from Madurai’s Government Rajaji Hospital on Friday according to the district adminis

Contributions of experimental and selected theoretical charge-density research to medicinal chemistry are reviewed; combining experimental methods from high-resolution small-molecule and macromolecular crystallography with theory proves to be fruitful.

Benzo[1,2-c:3,4-c':5,6-c'']tri­thio­phene (D3h-BTT) is an easily prepared electron donor that readily forms charge–transfer complexes with organic acceptors. We report here two crystal structures of its charge–transfer complexes with 7,7,8,8-tetra­cyano­quinodi­methane (TCNQ) and buckminsterfullerene (C60). The D3h-BTT·TCNQ complex, C12H6S3·C12H4N4, crystallizes with mixed layers of donors and acceptors, with an estimated degree of charge transfer at 0.09 e. In the D3h-BTT·C60·toluene complex, C12H6S3·C60·C7H8, the central ring of BTT is `squeezed' by the C60 mol­ecules from both faces. However, the degree of charge transfer is low. The C60 unit is disordered over two sites in a 0.766 (3):0.234 (3) ratio and was refined as a two-component inversion twin.

The data quality requirements for charge density studies on actinide compounds are extreme. Important steps in data collection and reduction required to obtain such data are summarized and evaluated. The steps involved in building an augmented Hansen–Coppens multipole model for an actinide pseudo-atom are provided. The number and choice of radial functions, in particular the definition of the core, valence and pseudo-valence terms are discussed. The conclusions in this paper are based on a re-examination and improvement of a previously reported study on [PPh4][UF6]. Topological analysis of the total electron density shows remarkable agreement between experiment and theory; however, there are significant differences in the Laplacian distribution close to the uranium atoms which may be due to the effective core potential employed for the theoretical calculations.

High-resolution single-crystal X-ray measurements of the monoclinic polymorph of bicalutamide and the aspherical atom databank approach have served as a basis for a reconstruction of the charge density distribution of the drug and its androgen receptor (AR) and albumin complexes. The contributions of various types of intermolecular interactions to the total crystal energy or ligand:AR energy were estimated. The cyan and amide groups secured the ligand placement in the albumin (Lys-137) and the AR binding pocket (Leu-704, Asn-705, Arg-752), and also determined the packing of the small-molecule crystals. The total electrostatic interaction energy on average was −230 kJ mol−1, comparable with the electrostatic lattice energy of the monoclinic bicalutamide polymorph. This is the result of similar distributions of electropositive and electronegative regions on the experimental and theoretical molecular electrostatic potential maps despite differences in molecular conformations. In general, bicalutamide interacted with the studied proteins with similar electrostatic interaction energies and adjusted its conformation and electrostatic potential to fit the binding pocket in such a way as to enhance the interactions, e.g. hydrogen bonds and π⋯π stacking.

Single crystals of the m = 8 member of the low-dimensional monophosphate tungsten bronzes (PO2)4(WO3)2m family were grown by chemical vapour transport technique and the high crystalline quality obtained allowed a reinvestigation of the physical and structural properties. Resistivity measurements revealed three anomalies at TC1 = 258 K, TC2 = 245 K and TC3 = 140 K, never observed until now. Parallel X-ray diffraction investigations showed a specific signature associated with three structural transitions, i.e. the appearance of different sets of satellite reflections below TC1, TC2 and TC3. Several harmonics of intense satellite reflections were observed, reflecting the non-sinusoidal nature of the structural modulations and a strong electron–phonon coupling in the material. These transitions could be associated with the formation of three successive unconventional charge density wave states.

X-ray diffraction studies of crystals under pressure and quantitative experimental charge density analysis are among the most demanding types of crystallographic research. A successful feasibility study of the electron density in the mineral grossular under 1 GPa pressure conducted at the CRISTAL beamline at the SOLEIL synchrotron is presented in this work. A single crystal was placed in a diamond anvil cell, but owing to its special design (wide opening angle), short synchrotron wavelength and the high symmetry of the crystal, data with high completeness and high resolution were collected. This allowed refinement of a full multipole model of experimental electron distribution. Results are consistent with the benchmark measurement conducted without a diamond-anvil cell and also with the literature describing investigations of similar structures. Results of theoretical calculations of electron density distribution on the basis of dynamic structure factors mimic experimental findings very well. Such studies allow for laboratory simulations of processes which take place in the Earth's mantle.

Oxidation states of individual metal atoms within a metalloprotein can be assigned by examining X-ray absorption edges, which shift to higher energy for progressively more positive valence numbers. Indeed, X-ray crystallography is well suited for such a measurement, owing to its ability to spatially resolve the scattering contributions of individual metal atoms that have distinct electronic environments contributing to protein function. However, as the magnitude of the shift is quite small, about +2 eV per valence state for iron, it has only been possible to measure the effect when performed with monochromated X-ray sources at synchrotron facilities with energy resolutions in the range 2–3 × 10−4 (ΔE/E). This paper tests whether X-ray free-electron laser (XFEL) pulses, which have a broader bandpass (ΔE/E = 3 × 10−3) when used without a monochromator, might also be useful for such studies. The program nanoBragg is used to simulate serial femtosecond crystallography (SFX) diffraction images with sufficient granularity to model the XFEL spectrum, the crystal mosaicity and the wavelength-dependent anomalous scattering factors contributed by two differently charged iron centers in the 110-amino-acid protein, ferredoxin. Bayesian methods are then used to deduce, from the simulated data, the most likely X-ray absorption curves for each metal atom in the protein, which agree well with the curves chosen for the simulation. The data analysis relies critically on the ability to measure the incident spectrum for each pulse, and also on the nanoBragg simulator to predict the size, shape and intensity profile of Bragg spots based on an underlying physical model that includes the absorption curves, which are then modified to produce the best agreement with the simulated data. This inference methodology potentially enables the use of SFX diffraction for the study of metalloenzyme mechanisms and, in general, offers a more detailed approach to Bragg spot data reduction.

The outer membrane of Gram-negative bacteria is highly impermeable to hydrophilic molecules of larger than 600 Da, protecting these bacteria from toxins present in the environment. In order to transport nutrients across this impermeable membrane, Gram-negative bacteria utilize a diverse family of outer-membrane proteins called TonB-dependent transporters. The majority of the members of this family transport iron-containing substrates. However, it is becoming increasingly clear that TonB-dependent transporters target chemically diverse substrates. In this work, the structure and phylogenetic distribution of the TonB-dependent transporter YncD are investigated. It is shown that while YncD is present in some enteropathogens, including Escherichia coli and Salmonella spp., it is also widespread in Gammaproteobacteria and Betaproteobacteria of environmental origin. The structure of YncD was determined, showing that despite a distant evolutionary relationship, it shares structural features with the ferric citrate transporter FecA, including a compact positively charged substrate-binding site. Despite these shared features, it is shown that YncD does not contribute to the growth of E. coli in pure culture under iron-limiting conditions or with ferric citrate as an iron source. Previous studies of transcriptional regulation in E. coli show that YncD is not induced under iron-limiting conditions and is unresponsive to the ferric uptake regulator (Fur). These observations, combined with the data presented here, suggest that YncD is not responsible for the transport of an iron-containing substrate.

National Zoo Veterinarian Katharine Hope treats about 2,000 animals from 400 different species. She and her colleagues care for a variety of animals, from small baby flamingos to adult Asian elephants, so there's no such thing as an average day.

The post National Zoo veterinarian Katharine Hope is in charge of the health of 2,000 animals from 400 different species. appeared first on Smithsonian Insider.

Internationally renowned artist Mark Bradford will debut one of his largest works to date with “Pickett’s Charge,” a monumental new commission that spans nearly 400 […]

The post Mark Bradford: Pickett’s Charge at the Hirshhorn Museum appeared first on Smithsonian Insider.

Supreme Court Justice Ruth Bader Ginsburg, seen in February, has been released from the hospital after treatment for a gallbladder condition.; Credit: Patrick Semansky/AP

After being treated on Tuesday for a gallbladder infection at Johns Hopkins Hospital in Baltimore, Supreme Court Justice Ruth Bader Ginsburg was discharged on Wednesday.

"She is doing well and glad to be home," according to a Supreme Court press release.

The court said over the next few weeks Ginsburg will return to Johns Hopkins Hospital for follow-up outpatient visits, and for a nonsurgical procedure to remove the gallstone.

Ginsburg, 87, participated in a virtual Supreme Court hearing on Wednesday from her hospital room. The justices and lawyers held unique oral argument sessions by phone all week because of the coronavirus pandemic.

Last year Ginsburg underwent three weeks of radiation for a cancerous tumor on her pancreas, and in December she was operated on for lung cancer.

This content is from Southern California Public Radio. View the original story at SCPR.org.

Shares of Energous Corp. skyrocketed after the company reported that it received certification from the FCC for its new, "groundbreaking" over-the-air, power-at-a-distance wireless charging WattUp® technology.

The health risks to humans of using recycled water to irrigate crops needs to be carefully managed. New research has demonstrated that ???managed aquifer recharge??? can be just as effective as conventional water treatments in improving the quality of recycled water for use in irrigation.

The health risks to humans of using recycled water to irrigate crops needs to be carefully managed. New research has demonstrated that ‘managed aquifer recharge’ can be just as effective as conventional water treatments in improving the quality of recycled water for use in irrigation.

Widespread use of antibiotics has led to pollution of waterways, potentially creating resistance among freshwater bacterial communities. A new study looked for antibiotic resistance genes in a river basin in Spain, revealing that wastewater discharges can promote the spread of antibiotic resistance in streams and small rivers.

A 56-year-old Perth man allegedly caught with child abuse material has been charged by the Western Australia Joint Anti Child Exploitation Team (WA JACET).

Electric vehicle owners on Oahu can plug in for a fast charge at one of three locations.

Resist the urge to throw away your old gadgets. Here's how to recycle, donate and sell.

Gross or practical? Soon you may be able to charge your phone by plugging it into the urinal.

A UCI scientist accidentally discovered a way to make a rechargeable, lithium-ion battery that could last for 400 years.

Become a fan of Mother Nature Network and win this top-of-the-line solar charging device -- perfect for your summer vacation.

Toyota, Nissan, Honda and Mitsubishi are working together to dramatically expand the number of public chargers available in Japan.

AT&T's ZERO Charger won’t draw electricity from a power outlet when disconnected from a mobile phone.

2014's big tech news comes early in the year with the announcement that Google plans to acquire Nest Labs for $3.2 billion in cash.

Wireless inductive charging built into furniture is a good idea whose time has not yet come.

The introduction of the 2015 Kia Soul EV brings the notion of a practical, affordable all-electric car closer to the driveway.

Charge Across Town is cutting carbon emissions with mobile charging. Just respect the two-hour limit.

Two separate projects funded by the Department of Energy are offering free home chargers. The only drawback? You have to pay for the electric vehicle.