Comparative analysis of serum and saliva samples using Raman spectroscopy: a high-throughput investigation in patients with polycystic ovary syndrome and periodontitis.

BACKGROUND: Polycystic ovary syndrome (PCOS) and periodontitis significantly affect women's oral and systemic health worldwide, and yet increase the risk of cardiovascular-metabolic diseases like diabetes and coronary heart disease. Regarding the PCOS-periodontitis connection, whether sex hormones, metabolic and inflammatory mediators could account for the underlying linking mechanism needs to be further investigated. This case-control study evaluated the hormonal, metabolic and inflammatory profiles in PCOS and non-PCOS subjects with various periodontal conditions, via assessing serum and saliva samples by Raman spectroscopy. METHODS: A total of 66 females with PCOS and 22 systemically healthy female volunteers were recruited in a single hospital. Full-mouth periodontal examination was undertaken for identifying the subjects with periodontal health, gingivitis or periodontitis. The datasets of sex hormones and metabolic indicators were retrieved from the hospital information system. Both serum and saliva samples were collected for detecting inflammatory mediators and Raman spectroscopic assessment. The subjects were categorized into four groups according to their conditions of PCOS and periodontitis for Raman spectroscopic analysis. Partial least squares discriminant analysis was performed to examine the inter-group differences in Raman spectra. RESULTS: PCOS patients exhibited greater mean probing depth (P < 0.05) and higher serum levels of triglycerides (P < 0.05) and matrix metalloproteinase-8 (P < 0.05) than those in non-PCOS participants. Both probing depth and triglyceride level were positively correlated with PCOS (P < 0.05). There was a significant difference in mean Raman spectra of saliva samples among the four groups with different conditions of PCOS and periodontitis (P < 0.05), while no significant inter-group difference existed in serum samples. CONCLUSIONS: The present study shows that periodontal condition may affect the biomolecular profiles of Raman spectra in serum and saliva of PCOS patients. It underscores the importance of the collaborative teamwork of dentists and gynecologists for enhancing women's oral health, general wellbeing and quality of life.

Simulation on Heat Transfer and Emergency Protection of Tanks in a Tank Farm under Fire Scenario.

It is very important to understand the heat transfer process between storage tanks in a tank farm under a fire scenario, which is one of the key factors in determining the consequences of accident development. In this paper, a CFD simulation is used to study the heat transfer process and emergency protection of tanks under a fire scenario. The simulated results show that the changes in wind speed can affect the heat transfer of the tank farm. The highest temperature of the tanks at 5.3 m/s (wind speed) is 1432 K, while the highest temperature at 17.1 m/s (wind speed) is 1556 K. At the same time, the changes in wind direction can also affect the heat transfer of the tank farm. For the 45° east by north (wind direction), almost all tanks in the tank farm are affected by the fire. When the water curtain was applied as an emergency protection measure, the simulated highest temperature of the tanks decreased to 779 K (the cooling water intensity 6 L/min·m2), while the highest temperature of the tanks was 1432 K without water curtain protection under the actual fire conditions. The simulated highest temperature of the tanks decreased to 671 K when the emergency thermal insulation coating was sprayed on the surface of the tanks, which can effectively protect the adjacent tanks from being destroyed.

Hsa-circ-0000098 promotes the progression of hepatocellular carcinoma by regulation of miR-136-5p/MMP2 axis.

BACKGROUND: Many papers revealed the abnormal expression of circular RNA (circRNA), a kind of non-coding RNA, in mammals. However, the potential functional mechanisms are still unknown. OBJECTIVES: In this paper, we aimed to elucidate the function and mechanisms of hsa-circ-0000098 in hepatocellular carcinoma (HCC). MATERIAL AND METHODS: Bioinformatics was used to analyze the Gene Expression Omnibus (GEO) database (GSE97332) and predict the targeted gene site of miR-136-5p. The starBase online database was utilized to predict that MMP2 is the downstream target gene of miR-136-5p. The expression of hsa_circ_0000098, miR-136-5p and matrix metalloproteinase 2 (MMP2) in HCC tissues or cells was detected using quantitative real-time polymerase chain reaction (qRT-PCR) method. The migration and invasion abilities of processing cells were measured with transwell assay. The luciferase reporter assay was carried out to verify the targets of hsa_circ_0000098, MMP2 and miR-136-5p. The western blot assay was performed to detect the expression of MMP2, MMP9, E-cadherin, and N-cadherin. RESULTS: According to the analysis of GEO database of GSE97332, hsa_circ_0000098 had a prominent expression in HCC tissues. A continued analysis of relevant patients has verified that the high expression of hsa_circ_0000098 is present in HCC tissues with relative to poor prognosis. We also proved that the migration and invasion abilities of HCC cell lines can be inhibited by silencing hsa_circ_0000098. In view of the above findings, we continued to study the hsa_circ_0000098 mechanism of action in HCC. The study revealed that hsa_circ_0000098 can sponge miR-136-5p and then regulate MMP2, which is a downstream target gene of miR-136-5p, in order to promote HCC metastasis by regulation of miR-136-5p/MMP2 axis. CONCLUSIONS: Our data showed that has_circ_0000098 facilitates the migration, invasion and malignant progression of HCC. On the other hand, we demonstrated that the mechanism of action of hsa_circ_0000098 in HCC might be due to the regulation of miR-136-5p/MMP2 axis.

Concise synthesis of marine natural products smenodiol and (-)-pelorol.

A facile synthesis of marine natural product smenodiol has been achieved in 23.2% overall yield within 8 steps from readily available starting materials, which facilitates a concise synthesis of the marine natural product (-)-pelorol by employing a TMSOTf-mediated Friedel-Crafts reaction with a methyl ester in the aryl as the key step.

A concise synthesis of marine natural product (-)-15-oxopuupehenol from (+)-sclarelide.

A step-economical synthesis of (-)-15-oxopuupehenol from cheap and readily available (+)-sclarelide is achieved with 20.3% overall yield in 9 steps. The key features of this synthetic mythology include a palladium catalyzed tandem carbine migratory insertion reaction to construct the key skeleton, a DDQ-mediated isomerization/oxidation of allyl alcohol to afford α, ß-unsaturated ketone, and a NaOH-induced intramolecular Michael addition followed by acetonide deprotection to give (-)-15-oxopuupehenol.

Total Synthesis of Marine Natural Products (+)-Strongylin A and Corallidictyal D by Regio- and Stereoselective Cyclization of Alkenyl Benzenes.

An expeditious access to marine natural products (+)-strongylin A and corallidictyal D is described. A TFA/Et3SiH-induced reductive isomerization of enols I to alkenyl benzenes II followed by a selectivity-controlled cyclization in the presence of HCl and BF3·Et2O affords benzofuran III and benzopyran IV, respectively. The applicability of this HCl-induced cyclization is showcased by a regio- and stereoselective synthesis of corallidictyal D, while BF3·Et2O-promoted cyclization posterior to rearrangement of an alkenyl benzene provides a regioselectively different benzopyran, (+)-strongylin A.

Diversity oriented clicking delivers ß-substituted alkenyl sulfonyl fluorides as covalent human neutrophil elastase inhibitors.

Diversity Oriented Clicking (DOC) is a discovery method geared toward the rapid synthesis of functional libraries. It combines the best attributes of both classical and modern click chemistries. DOC strategies center upon the chemical diversification of core "SuFExable" hubs-exemplified by 2-Substituted-Alkynyl-1-Sulfonyl Fluorides (SASFs)-enabling the modular assembly of compounds through multiple reaction pathways. We report here a range of stereoselective Michael-type addition pathways from SASF hubs including reactions with secondary amines, carboxylates, 1H-1,2,3-triazole, and halides. These high yielding conjugate addition pathways deliver unprecedented ß-substituted alkenyl sulfonyl fluorides as single isomers with minimal purification, greatly enriching the repertoire of DOC and holding true to the fundamentals of modular click chemistry. Further, we demonstrate the potential for biological function - a key objective of click chemistry - of this family of SASF-derived molecules as covalent inhibitors of human neutrophil elastase.

Identification of simple arylfluorosulfates as potent agents against resistant bacteria.

Sulfur fluoride exchange (SuFEx), a next generation of click chemistry, opens an avenue for drug discovery. We report here the discovery and structure-activity relationship studies of a series of arylfluorosulfates, synthesized via SuFEx, as antibacterial agents. Arylfluorosulfates 3, 81, and 101 showed potency to overcome multidrug resistance and were not susceptible to the generation of resistance. They exhibited rapid bactericidal potency and selectively killed gram-positive bacterial strains. These compounds also exhibited the ability to disrupt established bacterial biofilm and kill persisters derived from biofilm. Furthermore, arylfluorosulfate 3 had a synergistic effect with streptomycin and gentamicin. In addition, their anti-MRSA potency was evaluated and determined by the Caenorhabditis elegans model.

Direct C2-arylation of N-acyl pyrroles with aryl halides under palladium catalysis.

C2-arylation of N-acyl pyrroles with aryl halides is developed for the first time using Pd(PPh3)4 as a catalyst in combination with Ag2CO3 under air, which allowed the application of a good compatibility catalytic system. This protocol provides a straightforward method for the preparation of valuable arylated pyrroles in moderate to good yields under the standard conditions with good substrate tolerance. Interestingly, while N-benzoyl pyrroles reacted well, the use of substrates with a thiophene or furan ring indicated that the thiophene and furan rings are more reactive than pyrrole for the present catalytic system.

Multi-label Arrhythmia Classification from Fixed-length Compressed ECG Segments in Real-time Wearable ECG Monitoring.

Recently, classification from compressed physiological signals in compressed sensing has been successfully applied to cardiovascular disease monitoring. However, in real-time wearable electrocardiogram (ECG) monitoring, it is very difficult to directly obtain the heartbeats information from compressed ECG signals. Thus arrhythmia classification from compressed ECG signals has to be handled in fixed-length segments instead of individual heartbeats. An inevitable issue is that a fixed-length ECG segment may contain multiple different types of arrhythmia. As a result, it is not appropriate to represent the multi-type real arrhythmia with a single label. In this paper, we first introduce multiple labels into fixed-length compressed ECG segments to challenge the arrhythmia classification issue. Then, we propose a deep learning model, which can directly classify multiple different types of arrhythmia from fixed-length compressed ECG segments with the advantages of low time cost for data processing and relatively high classification accuracy at a high compression ratio. Experimental results on the MIT-BIH arrhythmia database show that the exact match rate of our proposed method has reached 96.03% at CR(Compression Ratio)=70%, 94.99% at CR=80% and 93.19% at CR=90%.

Diversity Oriented Clicking (DOC): Divergent Synthesis of SuFExable Pharmacophores from 2-Substituted-Alkynyl-1-Sulfonyl Fluoride (SASF) Hubs.

Diversity Oriented Clicking (DOC) is a unified click-approach for the modular synthesis of lead-like structures through application of the wide family of click transformations. DOC evolved from the concept of achieving "diversity with ease", by combining classic C-C π-bond click chemistry with recent developments in connective SuFEx-technologies. We showcase 2-Substituted-Alkynyl-1-Sulfonyl Fluorides (SASFs) as a new class of connective hub in concert with a diverse selection of click-cycloaddition processes. Through the selective DOC of SASFs with a range of dipoles and cyclic dienes, we report a diverse click-library of 173 unique functional molecules in minimal synthetic steps. The SuFExable library comprises 10 discrete heterocyclic core structures derived from 1,3- and 1,5-dipoles; while reaction with cyclic dienes yields several three-dimensional bicyclic Diels-Alder adducts. Growing the library to 278 discrete compounds through late-stage modification was made possible through SuFEx click derivatization of the pendant sulfonyl fluoride group in 96 well-plates-demonstrating the versatility of the DOC approach for the rapid synthesis of diverse functional structures. Screening for function against MRSA (USA300) revealed several lead hits with improved activity over methicillin.

Robust Heart Rate Monitoring for Quasi-Periodic Motions by Wrist-Type PPG Signals.

Heart rate (HR) monitoring using photoplethysmography (PPG) is a promising feature in modern wearable devices. PPG is easily contaminated by motion artifacts (MA), hindering estimation of HR. For quasi-periodic motions, previous works generally focused on a few specific motions, such as walking and fast running. However, they may not work well for many different quasi-periodic motions where MA are very complex. In this paper, a robust HR monitoring scheme for different quasi-periodic motions using wrist-type PPG is proposed, which consists of dictionary learning for signal characteristics learning, human motion recognition for the current motion recognition and dictionary selection, sparse representation-based MA elimination for denoising, and spectral peak tracking for HR-related spectral peak tracking. The proposed scheme is robust to MA caused by different motions and has high accuracy. Experiments on six common quasi-periodic motions showed that the average absolute error of heart rate estimation was 2.40 beat per minute, and also showed that the proposed method is more robust than some state-of-the-art approaches for different motions.

Synthesis of natural product inulavosin via Ga(OTf)3-Catalyzed Hetero Diels-Alder Dimerization of salicyl alcohol derivative.

Inulavosin, a natural melanogenesis inhibitor, has been synthesized smoothly from readily available and inexpensive starting materials by using a Ga(OTf)3-catalyzed room temperature hetero Diels-Alder dimerization of salicyl alcohol derivative and a regioselective phenol monobromination as the key steps.

Health Impacts of Exposure to Gaseous Pollutants and Particulate Matter in Beijing-A Non-Linear Analysis Based on the New Evidence.

This paper aimed to estimate health risks focusing on respiratory diseases from exposure to gaseous multi-pollutants based on new data and revealed new evidence after the most stringent air pollution control plan in Beijing which was carried out in 2013. It used daily respiratory diseases outpatient data from a hospital located in Beijing with daily meteorological data and monitor data of air pollutants from local authorities. All data were collected from 2014 to 2016. Distributed lag non-linear model was employed. Results indicated that NO2 and CO had positive association with outpatients number on the day of the exposure (1.045 (95% confidence interval (CI): 1.003, 1.089) for CO and 1.022 (95% CI: 1.008, 1.036) for NO2) (and on the day after the exposure (1.026 (95% CI: 1.005, 1.048) for CO and 1.013 (95% CI: 1.005, 1.021) for NO2). Relative risk (RR) generally declines with the number of lags; ozone produces significant effects on the first day (RR = 0.993 (95% CI: 0.989, 0.998)) as well as second day (RR = 0.995 (95% CI: 0.991, 0.999)) after the exposure, while particulate pollutants did not produce significant effects. Effects from the short-term exposure to gaseous pollutants were robust after controlling for particulate matters. Our results contribute to a comprehensive understanding of the dependencies between the change of air pollutants concentration and their health effects in Beijing after the implementation of promising air regulations in 2013. Results of the study can be used to develop relevant measures minimizing the adverse health consequences of air pollutants and supporting sustainable development of Beijing as well as other rapidly growing Asian cities.

The expression of ubiquitin-specific peptidase 8 and its prognostic role in patients with breast cancer.

OBJECTIVES: To clarify the clinical relevance of ubiquitin-specific protease 8 (USP8) for patients with breast cancer (BC). METHODS: Previous BC microarray studies GSE37751, GSE7390, and GSE21653 were reanalyzed to determine the USP8 levels between BC patients and the corresponding normal breast tissues and the correlation between USP8 expression and clinical features and clinical outcomes of patients with BC. Gene set enrichment analysis (GSEA) was conducted to investigate the potential mechanisms. RESULTS: USP8 was downregulated in BC cells compared with that in normal breast tissues (P < 0.0001). The Χ2 test and logistic regression analysis demonstrated that patients in USP8 high-expression group were correlated with better clinical features (including histopathological grading, estrogen receptors, clinical risk group according to Nottingham prognostic index [NPI] criteria and clinical risk group according to Veridex signature) compared with patients in USP8 low-expression group. Kaplan-Meier survival and Cox proportional regression analysis suggested that USP8 predicted better survivals of BC patients in terms of distant metastasis-free survival, time to distant metastasis, disease-free survival, and overall survival. GSEA suggested that USP8 might impact the proliferation of BC cells through several biological processes associated tumorigenesis of BC. USP8 was significantly downregulated in BC patients (P < 0.0001). CONCLUSIONS: Our results demonstrated that USP8 might predict better clinical characteristics and might be a protective factor for patients with BC.

A Fast and Robust Non-Sparse Signal Recovery Algorithm for Wearable ECG Telemonitoring Using ADMM-Based Block Sparse Bayesian Learning.

Wearable telemonitoring of electrocardiogram (ECG) based on wireless body Area networks (WBAN) is a promising approach in next-generation patient-centric telecardiology solutions. In order to guarantee long-term effective operation of monitoring systems, the power consumption of the sensors must be strictly limited. Compressed sensing (CS) is an effective method to alleviate this problem. However, ECG signals in WBAN are usually non-sparse, and most traditional compressed sensing recovery algorithms have difficulty recovering non-sparse signals. In this paper, we proposed a fast and robust non-sparse signal recovery algorithm for wearable ECG telemonitoring. In the proposed algorithm, the alternating direction method of multipliers (ADMM) is used to accelerate the speed of block sparse Bayesian learning (BSBL) framework. We used the famous MIT-BIH Arrhythmia Database, MIT-BIH Long-Term ECG Database and ECG datasets collected in our practical wearable ECG telemonitoring system to verify the performance of the proposed algorithm. The experimental results show that the proposed algorithm can directly recover ECG signals with a satisfactory accuracy in a time domain without a dictionary matrix. Due to acceleration by ADMM, the proposed algorithm has a fast speed, and also it is robust for different ECG datasets. These results suggest that the proposed algorithm is very promising for wearable ECG telemonitoring.

Prenatal malnutrition and adult cognitive impairment: a natural experiment from the 1959-1961 Chinese famine.

The current measures of cognitive functioning in adulthood do not indicate a long-term association with prenatal exposure to the Dutch famine. However, whether such association emerges in China is poorly understood. We aimed to investigate the potential effect of prenatal exposure to the 1959-1961 Chinese famine on adult cognitive impairment. We obtained data from the Second National Sample Survey on Disability implemented in thirty-one provinces in 2006, and restricted our analysis to 387 093 individuals born in 1956-1965. Cognitive impairment was defined as intelligence quotient (IQ) score under 70 and IQ of adults was evaluated by the Wechsler Adult Intelligence Scale - China Revision. Famine severity was defined as excess death rate. The famine impact on adult cognitive impairment was estimated by difference-in-difference models, established by examining the variations of famine exposure across birth cohorts. Results show that compared with adults born in 1956-1958, those who were exposed to Chinese famine during gestation (born in 1959-1961) were at greater risk of cognitive impairment in the total sample. Stratified analyses showed that this effect was evident in males and females, but only in rural, not in urban areas. In conclusion, prenatal exposure to famine had an enduring deleterious effect on risk of cognitive impairment in rural adults.

A Robust Random Forest-Based Approach for Heart Rate Monitoring Using Photoplethysmography Signal Contaminated by Intense Motion Artifacts.

The estimation of heart rate (HR) based on wearable devices is of interest in fitness. Photoplethysmography (PPG) is a promising approach to estimate HR due to low cost; however, it is easily corrupted by motion artifacts (MA). In this work, a robust approach based on random forest is proposed for accurately estimating HR from the photoplethysmography signal contaminated by intense motion artifacts, consisting of two stages. Stage 1 proposes a hybrid method to effectively remove MA with a low computation complexity, where two MA removal algorithms are combined by an accurate binary decision algorithm whose aim is to decide whether or not to adopt the second MA removal algorithm. Stage 2 proposes a random forest-based spectral peak-tracking algorithm, whose aim is to locate the spectral peak corresponding to HR, formulating the problem of spectral peak tracking into a pattern classification problem. Experiments on the PPG datasets including 22 subjects used in the 2015 IEEE Signal Processing Cup showed that the proposed approach achieved the average absolute error of 1.65 beats per minute (BPM) on the 22 PPG datasets. Compared to state-of-the-art approaches, the proposed approach has better accuracy and robustness to intense motion artifacts, indicating its potential use in wearable sensors for health monitoring and fitness tracking.

Relationship between Intrauterine Bacterial Infection and Early Embryonic Developmental Arrest.

BACKGROUND: Early embryonic developmental arrest is the most commonly understudied adverse outcome of pregnancy. The relevance of intrauterine infection to spontaneous embryonic death is rarely studied and remains unclear. This study aimed to investigate the relationship between intrauterine bacterial infection and early embryonic developmental arrest. METHODS: Embryonic chorion tissue and uterine swabs for bacterial detection were obtained from 33 patients who underwent artificial abortion (control group) and from 45 patients who displayed early embryonic developmental arrest (trial group). RESULTS: Intrauterine bacterial infection was discovered in both groups. The infection rate was 24.44% (11/45) in the early embryonic developmental arrest group and 9.09% (3/33) in the artificial abortion group. Classification analysis revealed that the highest detection rate for Micrococcus luteus in the early embryonic developmental arrest group was 13.33% (6/45), and none was detected in the artificial abortion group. M. luteus infection was significantly different between the groups (P < 0.05 as shown by Fisher's exact test). In addition, no correlation was found between intrauterine bacterial infection and history of early embryonic developmental arrest. CONCLUSIONS: M. luteus infection is related to early embryonic developmental arrest and might be one of its causative factors.

Highly sensitive and selective fluorometric/electrochemical dual-channel sensors for TNT and DNT explosives.

A novel electro-active compound, TCAC, is synthesized and its electrochemical polymerized film is used to detect 2,4,6-trinitrotoluene (TNT) and 2,4-dinitrotoluene (DNT) explosives through a fluorometric/electrochemical dual-channel sensor with high sensitivity and selectivity. In particular, the electrochemical sensor for the analysis of TNT had an enhanced sensitivity of 0.5 µM. The detection limit of the sensor was calculated to be 15 nM.