Absolute Intensity Research Articles

Effects of a reduced in‐office bleaching protocol with 37.5% hydrogen peroxide on effectiveness and tooth sensitivity: A double‐blind randomized clinical trial

This randomized clinical trial evaluated the effectiveness and tooth sensitivity (TS) of 37.5% hydrogen peroxide (37.5HP) in-office bleaching with reduced protocol. Forty participants with shade mean C2 or darker for the six maxillary anterior teeth were randomly allocated into two treatment groups (n=20): two (37.5HP2) or three (37.5HP3) 8min applications/clinical session. Three clinical sessions were performed with a 1week interval. Color evaluations were done with a spectrophotometer at baseline and 1week post-bleaching. TS was measured during and up to 48 h after bleaching using a five-point numeric rating scale. Color change was evaluated by Student's t-test for independent samples. The absolute risk and intensity of TS were analyzed by Fisher's and Mann-Whitney/Friedman tests (p < 0.05). Both treatment groups resulted in a significant tooth whitening 1week post-bleaching (p < 0.001). There were no significant differences between 37.5HP2 and 37.5HP3 for ΔE*ab , ΔE00 and ∆WID . Also, there were not differences between groups regarding high absolute risk (p=1.0) and low intensity of TS at all time assessments (p > 0.7). The in-office bleaching with two 37.5% HP applications produced the same whitening degree, risk and intensity of TS to that performed with three gel applications. Clinicians should opt to use a neutral 37.5% HP in-office bleaching gel for two 8min applications/clinical session because produces the same whitening effectiveness, risk and low intensity of TS as the protocol proposed by manufacturer (three 8min applications).

Wnt5a Can Induce Activation of Rac1 and Proliferation in Mantle Cell Lymphoma Via a ROR1-Dependent, but BTK-Independent, Signaling Pathway

Signaling via the B cell receptor (BCR) plays an important role in the pathogenesis and progression of chronic lymphocytic leukemia (CLL) or mantle cell lymphoma (MCL). This is underscored by the clinical effectiveness of an inhibitor of Bruton's tyrosine kinase (BTK), ibrutinib, which can block BCR-signaling. However, ibrutinib cannot induce complete responses (CR) or durable remissions without continued therapy, particularly in patients with MCL. This suggests that ancillary pathways contribute to the growth/survival of MCL/CLL that are independent of BCR-signaling and/or inhibition of BTK. Studies have found that Wnt5a can promote activation of Rho GTPase Rac1 to enhance CLL-cell proliferation and survival via a ROR1-dependent,but BTK-independent pathway (Yu J, et al., Leukemia 31:1333, 2017). Furthermore, Wnt5a-induced Rac1 activation could be blocked by cirmtuzumab, a humanized anti-ROR1 mAb, which significantly could enhance the capacity of ibrutinib to clear CLL cells in vivo . MCL cells also express ROR1. Moreover, we find that the median level of ROR1 on primary MCL cells is higher than that on CLL cells; the median absolute mean fluorescence intensity of ROR1 (ROR1 DMFI) on MCL (87.5 ± 18.5 (S.D.), N = 8) was significantly higher than the median ROR1 DMFI on CLL cells (38.5 ± 18.5 (S.D.), N = 1567; (Cui B, et al., Blood 128:2931, 2016)). We also found that the plasma of patients with MCL had high levels of Wnt5a that were comparable to those found in patients with CLL; in contrast Wnt5a was virtually undetectable in the plasma of age-matched healthy adults. We cultured primary MCL cells of different patients with ibrutinib, cirmtuzumab, or both ibrutinib and cirmtuzumab for 2 h, and then stimulated the cells with exogenous Wnt5a for 30 min. In parallel, the same MCL cells were cultured without exogenous Wnt5a. We found that Wnt5a induced Rac1 activation in the primary MCL cells. Cirmtuzumab, but not ibrutinib, could inhibit the capacity of Wnt5a to induce primary MCL cells to activate Rac1. We induced proliferation of MCL cells by co-culturing MCL cells with HeLa cells expressing CD154 (HeLaCD154) and recombinant interleukin (IL)-4 and IL-10. Addition of exogenous Wnt5a to co-cultures of MCL cells with HeLaCD154 cells and IL-4/10 significantly enhanced the proportion of dividing MCL entering S/G2 and the numbers of cell divisions over time. Treatment of the MCL cells with cirmtuzumab, but not ibrutinib, blocked Wnt5a-enhanced survival and proliferation of MCL cells from each of 3 different patients. This study demonstrates that Wnt5a can induce Rac1 activation, which leads to enhanced proliferation and survival of primary MCL cells via a ROR1-dependent signaling pathway that can be blocked by cirmtuzumab. On the other hand, this signaling pathway cannot be blocked by ibrutinib, even at concentrations that completely inhibit BTK or BCR-signaling. This implies that cirmtuzumab and ibrutinib may have additive, if not synergistic, activity in the treatment of patients with MCL. DisclosuresKipps:Celgene: Consultancy, Honoraria, Research Funding; AbbVie: Consultancy, Honoraria, Research Funding; Gilead: Consultancy, Honoraria, Speakers Bureau; Pharmacyclics, LLC, an AbbVie Company: Consultancy, Honoraria; Roche: Consultancy, Honoraria; Oncternal: Research Funding.

Towards the intensity consistency of the ozone bands in the infrared range: Ab initio corrections to the S&MPO database

Accurate knowledge of line parameters, and particularly line intensities is of primary importance for satellite, ground based and balloon measurements of the ozone concentration in the atmosphere. Self-consistency in absolute band intensities of ozone in various spectral intervals is necessary to avoid discrepancies in the atmospheric ozone retrieval from different windows. Difficulties in precise experimental characterization of absolute line intensities of this unstable molecule are well known leading to many significant deviations in published intensity values and in spectroscopic compilations. Ab initio intensities computed from the dipole moment functions of our previous works (Tyuterev et al. JCP 2017;146:064304; JCP 2019;150:184303) have permitted achieving a consistency between Stark-effect measurements and various databases in 10 and 5 µm in a good agreement with the most accurate recent experiments. In this paper we extend ab initio corrections to available line lists of ozone band intensities in wider IR range up to the bands with four vibrational quanta. About 40% of intensities were corrected in the 0 - 4122 cm−1 range for thirty cold and hot bands of the main ozone 16O3 isotopologue. Most of them, but not all, were obtained using band specific scaling factors ranging from 0.75 to 1.17 making quite significant changes in the absolute values. The full line lists containing corrected line intensities in the spectral intervals considered in the paper are provided in the Supplementary material for this work. The resulting line list is now available on the web site of the “Spectroscopy and Molecular Properties of Ozone” (S&MPO) information system (http://smpo.iao.ru; http://smpo.univ-reims.fr). A large part of this line list including the ab initio correction reported in this work will be used in the future HITRAN20 update.

Associations of fitness, motor competence, and adiposity with the indicators of physical activity intensity during different physical activities in children

We investigated the associations of peak oxygen uptake (V̇O2peak), ventilatory threshold (VT), muscle strength, motor competence (MC), and adiposity with the indicators of PA intensity during different physical activities used to create absolute PA intensity cut-offs among 35 children 7–11-years-of-age. V̇O2peak was defined as the highest V̇O2 achieved in the maximal cardiopulmonary exercise test (CPET) on a cycle ergometer, self-paced running, or running on a treadmill at 8 km/h. VT was defined from the CPET data. Peak isometric knee extensor and flexor strength was assessed by a dynamometer, MC by the Körperkoordination test für Kinder tests, and body composition by the bioelectrical impedance analysis. PA intensity was assessed using V̇O2 as a % of V̇O2reserve or V̇O2 at VT, mean amplitude deviation (MAD) measured by accelerometry, metabolic equivalent of task (MET), and muscle activity measured by textile electromyography during walking or running on a treadmill at 4, 6, and 8 km/h, playing hopscotch, walking up and down the stairs, self-paced walking, and self-paced running. Children with lower V̇O2peak, V̇O2 at VT, and MC operated at higher intensity level during given physical task than their peers with higher fitness and MC when PA intensity was expressed using relative PA intensity using V̇O2 as a % of V̇O2reserve or V̇O2 at VT (p < 0.05). MAD and METs during different tasks were not able to discriminate PA intensity between children with varying levels of physical fitness or MC. Traditionally used absolute measures of PA intensity based on accelerometry or MET underestimated PA intensity in children with lower V̇O2peak, V̇O2 at VT, and MC.

&amp;beta;-decay and isospin symmetry breaking

<p indent=0mm>The elegant concept of isospin symmetry is of fundamental importance in nuclear and elementary particle physics. As a β-decay process changes an up quark to a down quark or <italic>vice versa</italic>, studies of nuclei with exchanged numbers of neutrons and protons, known as mirror nuclei, can be a powerful means to probe isospin symmetry breaking. A series of β-decay experiments of sd-shell nuclei near the proton drip line produced by projectile fragmentation were performed at the Radioactive Ion Beam Line of the Heavy Ion Research Facility in Lanzhou (HIRFL-RIBLL1) using a silicon array with a high detection efficiency and a low detection threshold. The secondary ions were identified by the combination of Δ<italic>E</italic>-TOF and magnetic rigidity (<italic>Bρ</italic>) in which the time of flight (TOF) was measured by two plastic scintillators at the second and fourth focal planes of the RIBLL1 and the energy loss (Δ<italic>E</italic>) was measured by two silicon detectors in the front of the silicon array. Double-sided silicon strip detectors (DSSDs) in the center of the array served to measure the residual energies of secondary ions on an event-by-event basis and study their decay properties with an implantation-decay correlation. Several quadrant silicon detectors (QSDs) placed behind DSSDs were used for anticoincidences of the penetrating fragments and light particles coming along with the beam, and measurements of β particles and high-energy protons. The β-delayed proton peaks with known energies and their corresponding absolute intensities were used for the energy and detection efficiency calibrations of the DSSDs. The system allows us to measure protons with energies down to about <sc>200 keV</sc> without obvious β background in the proton spectrum and was successful to measure the energies, time, and positions of implanted ions and decay protons efficiently, supporting researchers to study the decay properties of nuclei towards the proton drip line. The β-decay data, together with the large-scale shell-model calculations, allows detailed investigations on the mirror-nuclei systems resulting in the systematic study of isospin symmetry breaking in the sd-shell nuclear region. It was found that the mirror asymmetry parameters become larger due to the smaller separation energies while approaching the proton drip line for the extremely proton-rich sulfur nuclei ^27,28,29S and the Coulomb forces and other isospin-symmetry nonconserving forces acting between protons would lead to extended proton wave functions and cause mirror asymmetries. The properties of ²²Si β-decay for the transitions to the low-lying states of ²²Al were measured, and the reduced transition probabilities were determined. Comparing with the data on the β-decay of the mirror nucleus ²²O, we found a mirror asymmetry of <italic>δ</italic>=209(96)% in the transition to the first 1⁺ excited state of the respective daughters. This is by far the largest value of <italic>δ</italic> observed in the low-lying states. Shell-model calculations with isospin-nonconserving forces, including the <italic>T</italic>=1,<italic> J</italic>=2, 3 interactions related to the s_1/2 orbit that introduces explicitly the isospin-symmetry breaking force and describes the loosely bound nature of the wave functions of the s_1/2 orbit, can reproduce the observed data well and demonstrate that this dramatically large mirror asymmetry is attributed to the significant proton occupation and loosely bound nature of the wave functions of the s_1/2 orbit, which suggests that ²²Al is a proton-halo nucleus.

The Low-Lying Electronic States of NO2: Potential Energy and Dipole Surfaces, Bound States, and Electronic Absorption Spectrum.

Nitrogen dioxide, NO2, is a free radical composed of the two most abundant elements in Earth's atmosphere, nitrogen and oxygen, and is relevant to atmospheric and combustion chemistry. The electronic structure of even its lowest-lying states is remarkably complex, with various conical intersections and Renner-Teller pairings, giving rise to complex and perturbed vibronic states. Here we report some analysis of the 18 molecular states of doublet spin-multiplicity formed by combining ground-state N(4Su) and O(3Pg) atoms. Three-dimensional potential energy surfaces were fit at the MRCI(Q)-F12/VTZ-F12 level, describing the lowest four (X̃, Ã, B̃, and C̃) electronic states. A properties-based diabatization procedure was applied to accommodate the intersections, producing energies in a quasidiabatic representation and yielding couplings that were also fit into surfaces. The low-lying vibrational levels on the ground X̃ state were computed and compared with experimental measurements. Compared to experiment, the lowest 125 calculated vibrational levels (up to 8500 cm-1 above the zero-point energy) have a root-mean-squared error of 16.5 cm-1. In addition, dipole moments for each of the lowest four electronic states-and the transition dipoles between them-were also computed and fit. With the coupled energy and dipole surfaces, the electronic spectrum was calculated in absolute intensity and compared with experimental measurements. Detailed structure in the experimental spectrum was successfully reproduced, and the total integrated intensity matches experiment to an accuracy of ∼1.5% with no empirical adjustments.

Investigation of novel brominated triazine-based flame retardant (TDBP-TAZTO) and its transformation products emitted from fire-retarded textile manufacturing facility and its downstream sewage treatment plant

Investigation of transformation products from novel flame retardants emitted throughout their life cycles is crucial for understanding and predicting environmental and human health risks posed by them during the material and product life cycle. Here, to understand more about the emission of TDBP-TAZTO to the environment, we investigated the presence of novel brominated triazine-based flame retardant 1,3,5-tris-(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione (TDBP-TAZTO) and its transformation products in the effluent from a facility manufacturing fire-retarded textiles, and in the influent, effluent, and sludge of its closest downstream sewage treatment plant. To acquire mass spectra data of the transformation products in the influent, effluent, and sludge, non-target analysis was carried out by electrospray ionization−quadrupole time-of-flight−high-resolution mass spectrometry with liquid chromatography (LC−ESI−QTOF−HRMS). Then, the HaloSeeker 2.0 software was used to filter the mass spectrometry data for signals attributable to halogenated compounds. Combination of LC−ESI−QTOF−HRMS accurate mass measurements and HaloSeeker screening allowed us to determine the most probable elemental compositions and structures of 11 transformation products from TDBP-TAZTO and to construct a possible transformation pathway that included dehydrobromination, hydroxylation, and decarbonylation reactions. Based on analysis of the absolute intensities, we found that TDBP-TAZTO and its transformation products may not be easily removed by current sewage treatment plant process. There are increasing concerns about environmental contamination by TDBP-TAZTO and its transformation products different from the one which have previously been considered to be c-decaBDE and its lower brominated congeners. However, the present data suggest that concern is also warranted over the presence of TDBP-TAZTO and its transformation products in the environment. The present data will be useful for assessing, predicting, and understanding the environmental contamination and human health risks posed by TDBP-TAZTO, and for considering appropriate measures to control the emission of TDBP-TAZTO and its transformation products during product life cycles.

Exercise temperature regulation following a 35-day horizontal bedrest.

What is the central question of this study? Does a 35-day horizontal bedrest impair thermoeffector responses during whole-body submaximal exercise performed in temperate conditions? What is the main finding and its importance? Cardiovascular and muscular deconditioning ensuing from prolonged recumbency seems to augment, at least to a degree, exercise-induced increase in body core temperature, most likely due to an impairment in non-evaporative heat loss. The response is a function of the absolute exercise intensity imposed. We examined the effects of a 35-day horizontal bedrest on thermoregulation during whole-body exercise. Fifteen healthy men were randomly assigned to either a bedrest (BR; n=10) or a control (CON; n=5) group. Prior to bedrest, both groups performed 40-min constant-load upright cycling at 30% of their peak workload (Wpeak ; PRE). One and 2days after bedrest, the BR group performed, in a randomised counterbalanced order, two 40-min trials at 30% of (i) the pre-bedrest Wpeak (i.e., at a fixed absolute intensity; POST-A) and (ii) the post-bedrest Wpeak (i.e., at a fixed relative intensity; POST-R). The CON group conducted only the POST-A trial, at the same time intervals. During the trials, rectal (Trec ) and skin ( sk ) temperatures, and the forehead sweating rate (SwR) were monitored. In the CON group, no differences were observed between the trials. Bedrest potentiated moderately the Trec elevation during the latter part of POST-A (∼0.10°C; P≤0.05), but not of POST-R (∼0.04°C; P=0.11). In both post-bedrest trials, sk was attenuated by ∼1.5-2.0°C throughout (P<0.01), whereas the forehead SwR was not modulated. Trec and sk were similar in POST-A and POST-R, yet the forehead SwR was more dependent on the relative workload imposed (P=0.04). The present findings therefore suggest that the cardiovascular and muscular deconditioning ensuing from a 35-day bedrest may aggravate the exercise-induced increase in body core temperature when working at a given absolute intensity, most likely due to an impairment in non-evaporative heat loss.

Coadministration of ibuprofen/caffeine on bleaching-induced tooth sensitivity: A randomized clinical trial

This clinical trial evaluated the effect of the coadministration of ibuprofen/caffeine on bleaching-induced tooth sensitivity (TS). A triple-blind, parallel-design, randomized clinical trial was conducted on 84 patients who received ibuprofen/caffeine or placebo capsules. The drugs were administered for 48 hours, starting 1 hour before the in-office bleaching. Two bleaching sessions were performed with 35% hydrogen peroxide gel with 1-week interval. TS was recorded up to 48 hours after dental bleaching with a 0-10 visual analogic scale (VAS) and a 5-point numeric rating scale (NRS). The color was evaluated with VITA Classical and VITA Bleachedguide scales (ΔSGU) and VITA Easyshade spectrophotometer (ΔE*ab and ΔE00). The absolute risk of TS in both groups was evaluated using Fischer's exact test. Comparisons of the TS intensity (NRS and VAS data) were performed by using the Mann-Whitney test and a two-way repeated measures ANOVA, respectively. The color alteration between the groups was compared with the Student's t test. The significance level was 5%. There was no statistically significant difference between the groups for the absolute risk of TS (p = 1.00) or for the intensity of TS (p > 0.05). A bleaching of approximately 7 shade guide units was observed on the Vita Classical and Vita Bleachedguide scales, with no statistical difference between the groups. It was concluded that coadministration of ibuprofen and caffeine did not reduce the absolute risk or intensity of TS and did not interfere with the efficacy of dental bleaching.

(Invited) Sensing with Chirality Pure Near Infrared Fluorescent Carbon Nanotubes

Semiconducting single wall carbon nanotubes (SWCNTs) fluoresce in the near infrared (NIR) and the emission wavelength depends on their chirality (n,m). Interactions with the environment affect the fluorescence and can be tailored by functionalizing SWCNTs with biopolymers such as DNA, which is the basis for fluorescent biosensors. So far, such biosensors were mainly assembled from mixtures of SWCNT chiralities with large spectral overlap, which affects sensitivity as well as selectivity and prevents multiplexed sensing. The main challenge to gain chirality pure sensors has been to combine approaches to isolate specific SWCNTs and generic (bio)functionalization approaches. Here, we created chirality pure SWCNT-based NIR biosensors for important analytes such as neurotransmitters and investigated the impact of SWCNT chirality/handedness as well as long-term stability and sensitivity. For this purpose, we used aqueous two-phase extraction (ATPE) to gain chirality pure (6,5)-, (7,5)-, (9,4)- and (7,6)-SWCNTs (emission at ~ 990, 1040, 1115 and 1130 nm). Exchange of the surfactant sodium deoxycholate (DOC) to specific single-stranded (ss)DNA sequences yielded monochiral sensors for small analytes (dopamine, riboflavin, ascorbic acid, pH). DOC residues impaired sensitivity and therefore sufficient removal was necessary. The assembled monochiral sensors were up to 10 times brighter than their non-purified counterparts and the ssDNA sequence determined absolute fluorescence intensity as well as colloidal (long-term) stability and selectivity for the analytes. (GT)40-(6,5)-SWCNTs displayed the maximum fluorescence response to the neurotransmitter dopamine (+140 %, Kd = 1.9 x10-7 M) and a long-term stability > 14 days. The specific ssDNA sequences imparted selectivity to the analytes in majority of the cases independent of SWCNT chirality and handedness of (+/-) (6,5)-SWCNTs, which allows a predictable design. Finally, multiple monochiral/single-color SWCNTs were combined to achieve ratiometric/multiplexed sensing of the important analytes dopamine, riboflavin, H2O2 and pH. In summary, we demonstrated the assembly, characteristics and potential of monochiral (single-color) SWCNTs for multiple NIR fluorescent sensing applications.

Refining geomagnetic field intensity changes in Europe between 200 CE and 1800 CE. New data from the Mediterranean region

Absolute past geomagnetic intensity values can mainly be recovered by fired archaeological materials and volcanic rocks. Here, we present 10 new archeointensities from the Mediterranean region that help to better constrain geomagnetic field intensity changes in Europe over the last two millennia. The new archeointensity results were obtained from the Thellier classical method including thermoremanent magnetization (pTRM) checks and both the TRM anisotropy and cooling rate corrections and were derived from at least three specimens. The new data presented, together with a selection of previous archeointensities satisfying a set of quality criteria, confirm the presence of several intensity maxima in Europe over the last 2000 years. In particular, the new archeointensities allow to better define the starting point of the double-oscillation feature that occurred in Europe during the second half of the first millennium CE, and reinforce the existence of a relative maximum at the end of the 14th century - beginning of the 15th century in Western Europe. From selected European archeointensities two new paleosecular variation curves are constructed for Western and Eastern Europe using temporal cubic b-splines in a bootstrap approach. The obtained curves suggest that the occurrence of the intensity maxima is characterized by a period of about 300 ± 50 years. In addition, our results suggest that the maxima do not occur simultaneously in Western and Eastern Europe, pointing out an intensity eastward drift with a mean lag-time of about 100 years.

Real-Time Estimation of Aerobic Threshold and Exercise Intensity Distribution Using Fractal Correlation Properties of Heart Rate Variability: A Single-Case Field Application in a Former Olympic Triathlete.

A non-linear heart rate variability (HRV) index based on fractal correlation properties called alpha1 of Detrended Fluctuation Analysis (DFA-alpha1), has been shown to change with endurance exercise intensity. Its unique advantage is that it provides information about current absolute exercise intensity without prior lactate or gas exchange testing. Therefore, real-time assessment of this metric during field conditions using a wearable monitoring device could directly provide a valuable exercise intensity distribution without prior laboratory testing for different applied field settings in endurance sports. Until of late no mobile based product could display DFA-alpha1 in real-time using off the shelf consumer products. Recently an app designed for iOS and Android devices, HRV Logger, was updated to assess DFA-alpha1 in real-time. This brief research report illustrates the potential merits of real-time monitoring of this metric for the purposes of aerobic threshold (AT) estimation and exercise intensity demarcation between low (zone 1) and moderate (zone 2) in a former Olympic triathlete. In a single-case feasibility study, three practically relevant scenarios were successfully evaluated in cycling, (1) estimation of a HRV threshold (HRVT) as an adequate proxy for AT using Kubios HRV software via a typical cycling stage test, (2) estimation of the HRVT during real-time monitoring using a cycling 6 min stage test, (3) a simulated 1 h training ride with enforcement of low intensity boundaries and real-time HRVT confirmation. This single-case field evaluation illustrates the potential of an easy-to-use and low cost real-time estimation of the aerobic threshold and exercise intensity distribution using fractal correlation properties of HRV. Furthermore, this approach may enhance the translation of science into endurance sports practice for future real-world settings.

Exploring the Influence of Different Albumin Binders on Molecular Imaging Probe Distribution.

The biodistribution of molecular imaging probes or tracers mainly depends on the chemical nature of the probe and the preferred metabolization and excretion routes. Small molecules have rather short half-lives while antibodies reside inside the organism for a longer period of time. An excretion via kidneys and bladder is faster than a mainly hepatobiliary elimination. To manipulate the biodistribution behavior of probes, different strategies have been pursued, including utilizing serum albumin as an inherent transport mechanism for small molecules. Here, we modified an existing small molecular fluorescent probe targeted to the endothelin-A receptor (ETAR) with three different albumin-binding moieties to search for an optimal modification strategy. A diphenylcyclohexyl (DPCH) group, a p-iodophenyl butyric acid (IPBA), and a fatty acid (FA) group were attached via amino acid linkers. All three modifications result in transient albumin binding of the developed compounds, as concluded from gel electrophoresis investigations. Spectrophotometric measurements applying variable amounts of bovine, murine, and human serum albumin (BSA, MSA, and HSA) reveal distinct variations of absorption and emission intensities and shifts of their maximum wavelengths. Binding to MSA results in the weakest effects, while binding to HSA leads to the strongest. Cell-based in vitro investigations utilizing ETAR-positive HT-1080 fibrosarcoma and ETAR-negative BT-20 breast adenocarcinoma cells support a retained specific target-binding capacity of the modified compounds and different degrees of unspecific binding. In vivo analysis of a HT-1080 xenograft model in nude mice over the course of 1 week by fluorescence reflectance imaging illustrates noticeable differences between the four examined probes. While the IPBA-modified probe shows the highest absolute signal intensity values, the FA-modified probe exhibits the most favorable tumor-to-organ ratios. In summary, reversible binding to albumin enhances the biological half-life of the designed probes substantially and enables near infrared optical imaging of subcutaneous tumors for several days in vivo. Because the unmodified probe already exhibits reasonable results, the attachment of albumin-binding moieties does not lead to a substantially improved imaging outcome in terms of target-to-background ratios. On the other hand, because the implemented transient albumin binding results in an overall higher amount of probe inside tumor lesions, this strategy might be adaptable for theranostic or therapeutic approaches in a future clinical routine.

Measurements of the absolute timing jitter and intensity noise of an all-fiber Mamyshev oscillator.

We present the experimental investigation of timing jitter and relative intensity noise of a Mamyshev ring oscillator operating in the fundamental mode-lock regime. We find that both timing jitter and intensity noise spectra are correlated to the output optical power with noise increase close to the loss of the mode-locking. In addition, we have investigated the dependence of the spectral filters wavelength separation on both timing jitter and intensity noise showing a severe degradation with filters overlapping.

LC-MS/MS characterisation and determination of dansyl chloride derivatised glyphosate, aminomethylphosphonic acid (AMPA), and glufosinate in foods of plant and animal origin

Glyphosate and other polar and acidic pesticides have been particularly studied due to the concerns over widespread and intensive use. The chemical properties of these compounds necessitate use of customised methods, such as derivatisation or ion exchange chromatography. These approaches present a compatibility problem with ESI-MS due to presence of salts and non-volatile compounds. For that reason, a simple procedure has been developed for the extraction, pre-column derivatisation with dansyl chloride (5-(dimethylamino)naphthalene-1-sulfonyl chloride), and mass spectrometric detection of glyphosate, AMPA, and glufosinate after the separation on a C18stationary phase. The dansyl derivatives were characterised with ESI-MS and their separation from derivatisation reagent byproducts was demonstrated with UV absorption detection. Reagent byproducts eluted before the analytes and were separated from the analytes completely, thus the proposed procedure did not contaminate the mass spectrometers. The proposed procedure was evaluated with respect to the matrix effects and extraction efficiency, and was validated with different mass spectrometers for milk, cucumber, honey, porridge formula, bovine kidney and liver matrix. The LOQ was 10 μg kg−1 for AMPA and glufosinate, and 10–25 μg kg−1for glyphosate, depending on matrix. Measurement uncertainties ranged from 4 to 44%. Method performance was compared to the QuPPe (Quick Polar Pesticides) procedure in combination with a diethylamino-based column from Waters™. In the case of Orbitrap™ detection, the proposed procedure had a comparable performance to the QuPPe procedure. Although, improved peak shape, higher absolute peak intensity, and lower standard deviation of the calibration curve slope was observed with the proposed procedure. This could be explained by the superior electrospray stability and lower extent of ion suppression.

Multiconfigurational Quantum Chemistry Determinations of Absorption Cross Sections (σ) in the Gas Phase and Molar Extinction Coefficients (ε) in Aqueous Solution and Air-Water Interface.

Theoretical determinations of absorption cross sections (σ) in the gas phase and molar extinction coefficients (ε) in condensed phases (water solution, interfaces or surfaces, protein or nucleic acids embeddings, etc.) are of interest when rates of photochemical processes, J = ∫ ϕ(λ) σ(λ) I(λ) dλ, are needed, where ϕ(λ) and I(λ) are the quantum yield of the process and the irradiance of the light source, respectively, as functions of the wavelength λ. Efficient computational strategies based on single-reference quantum-chemistry methods have been developed enabling determinations of line shapes or, in some cases, achieving rovibrational resolution. Developments are however lacking for strongly correlated problems, with many excited states, high-order excitations, and/or near degeneracies between states of the same and different spin multiplicities. In this work, we define and compare the performance of distinct computational strategies using multiconfigurational quantum chemistry, nuclear sampling of the chromophore (by means of molecular dynamics, ab initio molecular dynamics, or Wigner sampling), and conformational and statistical sampling of the environment (by means of molecular dynamics). A new mathematical approach revisiting previous absolute orientation algorithms is also developed to improve alignments of geometries. These approaches are benchmarked through the nπ* band of acrolein not only in the gas phase and water solution but also in a gas-phase/water interface, a common situation for instance in atmospheric chemistry. Subsequently, the best strategy is used to compute the absorption band for the adduct formed upon addition of an OH radical to the C6 position of uracil and compared with the available experimental data. Overall, quantum Wigner sampling of the chromophore with molecular dynamics sampling of the environment with CASPT2 electronic-structure determinations arise as a powerful methodology to predict meaningful σ(λ) and ε(λ) band line shapes with accurate absolute intensities.

Perfusion Parameters in Near-Infrared Fluorescence Imaging with Indocyanine Green: A Systematic Review of the Literature.

(1) Background: Near-infrared fluorescence imaging is a technique capable of assessing tissue perfusion and has been adopted in various fields including plastic surgery, vascular surgery, coronary arterial disease, and gastrointestinal surgery. While the usefulness of this technique has been broadly explored, there is a large variety in the calculation of perfusion parameters. In this systematic review, we aim to provide a detailed overview of current perfusion parameters, and determine the perfusion parameters with the most potential for application in near-infrared fluorescence imaging. (2) Methods: A comprehensive search of the literature was performed in Pubmed, Embase, Medline, and Cochrane Review. We included all clinical studies referencing near-infrared perfusion parameters. (3) Results: A total of 1511 articles were found, of which, 113 were suitable for review, with a final selection of 59 articles. Near-infrared fluorescence imaging parameters are heterogeneous in their correlation to perfusion. Time-related parameters appear superior to absolute intensity parameters in a clinical setting. (4) Conclusions: This literature review demonstrates the variety of parameters selected for the quantification of perfusion in near-infrared fluorescence imaging.

Identifying sex differences in neuromuscular fatigue: the challenge of normalizing exercise intensity and interpreting the results between populations.

Identifying sex differences in neuromuscular fatigue: the challenge of normalizing exercise intensity and interpreting the results between populations.

Influence of intraoperative vasopressor use on indocyanine green fluorescence angiography: first evaluation in an experimental model

Intraoperative indocyanine green (ICG) fluorescence angiography has gained popularity and acceptance in many surgical fields for the real-time assessment of tissue perfusion. Although vasopressors have the potential to preclude an accurate assessment of tissue perfusion, there is a lack of literature with regards to its effect on ICG fluorescence angiography. An experimental porcine model was used to expose the small bowel for quantitative tissue perfusion assessment. Three increasing doses of norepinephrine infusion (0.1, 0.5, and 1.0 µg/kg/min) were administered intravenously over a 25-min interval. Time-to-peak fluorescence intensity (TTP) was the primary outcome. Secondary outcomes included absolute fluorescence intensity and local capillary lactate (LCL) levels. Five large pigs (mean weight: 40.3 ± 4.24 kg) were included. There was no significant difference in mean TTP (in seconds) at baseline (4.23) as compared to the second (3.90), third (4.41), fourth (4.60), and fifth ICG assessment (5.99). As a result of ICG accumulation, the mean and the maximum absolute fluorescence intensity were significantly different as compared to the baseline assessment. There was no significant difference in LCL levels (in mmol/L) at baseline (0.74) as compared to the second (0.82), third (0.64), fourth (0.60), and fifth assessment (0.62). Increasing doses of norepinephrine infusion have no significant influence on bowel perfusion using ICG fluorescence angiography.

Luminescent Analysis of Blood Serum for Diagnostics of Pathological and Pre-Pathological States of Cancer Patients.

This study is devoted to the development of a methodological approach to mathematical analysis and data interpretation of blood serum phosphorescence intensity in cancer patients for determining the pathological states and differential diagnostics of oncological process stages. The purpose of the study is blood serum phosphorescence research in patients with colorectal cancer (CRC) and stomach adenocarcinoma (SAC) and determination of the ultraweak luminescence role for diagnostics of the disease, determining its stages, control of pathogenetic therapy efficiency and forecast of recovery. The values of phosphorescence intensity of blood serum films in patients with CRC and SAC are significantly higher than the corresponding values for the control group. Contrary to the absolute intensity, the relative intensity increase compared to the control group is much more informative for oncoprocess diagnostics, since it exhibits three times increase even at the first stage of tumoral process. Serum phosphorescence intensity continues to increase with progressing of the disease. As the result of our study, the relative intensity increase compared to the first stage can be recommended as an informative indicator for differential diagnostics of oncological process stages. As a conclusion, determination of blood serum phosphorescence intensity can be considered as a sensitive and specific diagnostic method in oncology. With a correct methodological approach to data processing and interpretation, this method can be used in clinical practice for determining the oncopathological states, differential diagnostics of oncoprocess stages and diagnostics of precancer changes, which precede tumoral process development.