Hayeschoi7352

The structure of a neutron-rich ^25F nucleus is investigated by a quasifree (p,2p) knockout reaction at 270A MeV in inverse kinematics. The sum of spectroscopic factors of π0d_5/2 orbital is found to be 1.0±0.3. However, the spectroscopic factor with residual ^24O nucleus being in the ground state is found to be only 0.36±0.13, while those in the excited state is 0.65±0.25. The result shows that the ^24O core of ^25F nucleus significantly differs from a free ^24O nucleus, and the core consists of ∼35% ^24O_g.s.. and ∼65% excited ^24O. The result may infer that the addition of the 0d_5/2 proton considerably changes neutron structure in ^25F from that in ^24O, which could be a possible mechanism responsible for the oxygen dripline anomaly.Two-dimensional systems may admit a hexatic phase and hexatic-liquid transitions of different natures. The determination of their phase diagrams proved challenging, and indeed, those of hard disks, hard regular polygons, and inverse power-law potentials have only recently been clarified. In this context, the role of attractive forces is currently speculative, despite their prevalence at both the molecular and colloidal scale. Here, we demonstrate, via numerical simulations, that attraction promotes a discontinuous melting scenario with no hexatic phase. At high-temperature, Lennard-Jones particles and attractive polygons follow the shape-dominated melting scenario observed in hard disks and hard polygons, respectively. Conversely, all systems melt via a first-order transition with no hexatic phase at low temperature, where attractive forces dominate. The intermediate temperature melting scenario is shape dependent. Our results suggest that, in colloidal experiments, the tunability of the strength of the attractive forces allows for the observation of different melting scenarios in the same system.We report the first measurement of the (e,e^'p) three-body breakup reaction cross sections in helium-3 (^3He) and tritium (^3H) at large momentum transfer [⟨Q^2⟩≈1.9 (GeV/c)^2] and x_B>1 kinematics, where the cross section should be sensitive to quasielastic (QE) scattering from single nucleons. The data cover missing momenta 40≤p_miss≤500 MeV/c that, in the QE limit with no rescattering, equals the initial momentum of the probed nucleon. The measured cross sections are compared with state-of-the-art ab initio calculations. Overall good agreement, within ±20%, is observed between data and calculations for the full p_miss range for ^3H and for 100≤p_miss≤350 MeV/c for ^3He. Including the effects of rescattering of the outgoing nucleon improves agreement with the data at p_miss>250 MeV/c and suggests contributions from charge-exchange (SCX) rescattering. The isoscalar sum of ^3He plus ^3H, which is largely insensitive to SCX, is described by calculations to within the accuracy of the data over the entire p_miss range. This validates current models of the ground state of the three-nucleon system up to very high initial nucleon momenta of 500 MeV/c.Aryltrimethylgermane cation radicals were generated by nanosecond transient absorption spectroscopy. Transient kinetics experiments show that the aryltrimethylgermane cation radicals react with added nucleophiles in reactions that are first-order in both the cation radicals and the nucleophiles. Preparative photo-oxidation experiments demonstrate that the intermediate cation radicals react with nucleophiles, resulting in aryl-Ge or Me-Ge nucleophile-assisted fragmentations. The aryltrimethylgermane cation radicals were found to react more slowly than analogous stannane cation radicals; however, loss of the thermodynamically disfavored aryl radicals remains competitive with methyl radical loss.Dichlorprop [(RS)-2-(2,4-dichlorophenoxy)propanoic acid; DCPP], an important phenoxyalkanoic acid herbicide (PAAH), is extensively used in the form of racemic mixtures (Rac-DCPP), and the environmental fates of both DCPP enantiomers [(R)-DCPP and (S)-DCPP] mediated by microorganisms are of great concern. In this study, a bacterial strain Sphingopyxis sp. DBS4 was isolated from contaminated soil and was capable of utilizing both (R)-DCPP and (S)-DCPP as the sole carbon source for growth. Strain DBS4 preferentially catabolized (S)-DCPP as compared to (R)-DCPP. The optimal conditions for Rac-DCPP degradation by strain DBS4 were 30 °C and pH 7.0. In addition to Rac-DCPP, other PAAHs such as (RS)-2-(4-chloro-2-methylphenoxy)propanoic acid, 2,4-dichlorophenoxyacetic acid, 4-chloro-2-methylphenoxyacetic acid, and 2,4-dichlorophenoxyacetic acid butyl ester could also be catabolized by strain DBS4. Bioremediation of Rac-DCPP-contaminated soil by inoculation of strain DBS4 exhibited an effective removal of both (R)-DCPP and (S)-DCPP from the soil. Due to its broad substrate spectrum, strain DBS4 showed great potential in the bioremediation of PAAH-contaminated sites.As an important member of cytochrome P450 (CYP) enzymes, CYP17A1 is a dual-function monooxygenase with a critical role in the synthesis of many human steroid hormones, making it an attractive therapeutic target. The emerging structural information about CYP17A1 and the growing number of inhibitors for these enzymes call for a systematic strategy to delineate and classify mechanisms of ligand transport through tunnels that control catalytic activity. In this work, we applied an integrated computational strategy to different CYP17A1 systems with a panel of ligands to systematically study at the atomic level the mechanism of ligand-binding and tunneling dynamics. Atomistic simulations and binding free energy computations identify the dynamics of dominant tunnels and characterize energetic properties of critical residues responsible for ligand binding. The common transporting pathways including S, 3, and 2c tunnels were identified in CYP17A1 binding systems, while the 2c tunnel is a newly formed pathway upon ligand binding. We employed and integrated several computational approaches including the analysis of functional motions and sequence conservation, atomistic modeling of dynamic residue interaction networks, and perturbation response scanning analysis to dissect ligand tunneling mechanisms. The results revealed the hinge-binding and sliding motions as main functional modes of the tunnel dynamic, and a group of mediating residues as key regulators of tunnel conformational dynamics and allosteric communications. We have also examined and quantified the mutational effects on the tunnel composition, conformational dynamics, and long-range allosteric behavior. The results of this investigation are fully consistent with the experimental data, providing novel rationale to the experiments and offering valuable insights into the relationships between the structure and function of the channel networks and a robust atomistic model of activation mechanisms and allosteric interactions in CYP enzymes.Integration of the sensitivity-relevant electronics of nuclear magnetic resonance (NMR) and electron spin resonance (ESR) spectrometers on a single chip is a promising approach to improve the limit of detection, especially for samples in the nanoliter and subnanoliter range. Here, we demonstrate the cointegration on a single silicon chip of the front-end electronics of NMR and ESR detectors. The excitation/detection planar spiral microcoils of the NMR and ESR detectors are concentric and interrogate the same sample volume. This combination of sensors allows one to perform dynamic nuclear polarization (DNP) experiments using a single-chip-integrated microsystem having an area of about 2 mm2. In particular, we report 1H DNP-enhanced NMR experiments on liquid samples having a volume of about 1 nL performed at 10.7 GHz(ESR)/16 MHz(NMR). NMR enhancements as large as 50 are achieved on TEMPOL/H2O solutions at room temperature. The use of state-of-the-art submicrometer integrated circuit technologies should allow the future extension of the single-chip DNP microsystem approach proposed here up the THz(ESR)/GHz(NMR) region, corresponding to the strongest static magnetic fields currently available. Particularly interesting is the possibility to create arrays of such sensors for parallel DNP-enhanced NMR spectroscopy of nanoliter and subnanoliter samples.Two well-defined synthetic polyphosphazene immunoadjuvants, PCPP and PCEP, were studied for their ability to potentiate the immune response to the hepatitis C virus (HCV) E2 glycoprotein antigen in vivo. We report that PCEP induced significantly higher serum neutralization and HCV-specific IgG titers in mice compared to other adjuvants used in the study PCPP, Alum, and Addavax. PCEP also shifted the response toward the desirable balanced Th1/Th2 immunity, as evaluated by the antibody isotype ratio (IgG2a/IgG1). The in vivo results were analyzed in the context of antigen-adjuvant molecular interactions in the system and in vitro immunostimulatory activity of formulations. Asymmetric flow field flow fractionation (AF4) and dynamic light scattering (DLS) analysis showed that both PCPP and PCEP spontaneously self-assemble with the E2 glycoprotein with the formation of multimeric water-soluble complexes, which demonstrates the role of polyphosphazene macromolecules as vaccine delivery vehicles. Intrinsic in vitro immunostimulatory activity of polyphosphazene adjuvants, which was assessed using a mouse macrophage cell line, revealed comparable activities of both polymers and did not provide an explanation of their in vivo performance. However, PCEP complexes with E2 displayed greater stability against agglomeration and improved in vitro immunostimulatory activity compared to those of PCPP, which is in line with superior in vivo performance of PCEP. The results emphasize the importance of often neglected antigen-polyphosphazene self-assembly mechanisms in formulations, which can provide important insights on their in vivo behavior and facilitate the establishment of a structure-activity relationship for this important class of immunoadjuvants.This letter reports optomechanical effects occurring in a hybrid metal-halide perovskite single crystal (MAPbBr3) based on resonant ultrasound spectroscopy (RUS) measurements under continuous wave (CW) laser illumination. The optomechanical effects are a new phenomenon in hybrid perovskite single crystals where the elastic constant of a single crystal is measured by RUS probed under varying excitation conditions. Our studies show that applying a CW laser (405 nm) to the single-crystal face shifts the RUS peaks to higher frequencies by about 1-4% in the perovskite single crystal at room temperature. The light-induced shift of the RUS peaks can be observed only when photoexcitation is occurring, rather than during heating, by positioning the laser wavelength within the optical absorption spectrum. In contrast, positioning the laser wavelength outside of the optical absorption spectrum leads to an absence of RUS peak shifting. check details Clearly, the laser-light-induced RUS peak shifts shows that the crystal elastic moduli can be changed by photoexcitation, leading to an optomechanical phenomenon via excited states. Essentially, the observed optomechanical phenomenon reflects the fact that the mechanical properties can be optically changed through internal repulsive and attractive force constants by external photoexcitation in a hybrid perovskite single crystal.