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1.
FASEB J ; 37(7): e22998, 2023 07.
Artigo em Inglês | MEDLINE | ID: mdl-37289136

RESUMO

Dementia is a well-known syndrome and Alzheimer's disease (AD) is the main cause of dementia. Lipids play a key role in the pathogenesis of AD, however, the prediction value of serum lipidomics on AD remains unclear. This study aims to construct a lipid score system to predict the risk of progression from mild cognitive impairment (MCI) to AD. First, we used the least absolute shrinkage and selection operator (LASSO) Cox regression model to select the lipids that can signify the progression from MCI to AD based on 310 older adults with MCI. Then we constructed a lipid score based on 14 single lipids using Cox regression and estimated the association between the lipid score and progression from MCI to AD. The prevalence of AD in the low-, intermediate- and high-score groups was 42.3%, 59.8%, and 79.8%, respectively. The participants in the intermediate- and high-score group had a 1.65-fold (95% CI 1.10 to 2.47) and 3.55-fold (95% CI 2.40 to 5.26) higher risk of AD, respectively, as compared to those with low lipid scores. The lipid score showed moderate prediction efficacy (c-statistics > 0.72). These results suggested that the score system based on serum lipidomics is useful for the prediction of progression from MCI to AD.


Assuntos
Doença de Alzheimer , Disfunção Cognitiva , Humanos , Idoso , Doença de Alzheimer/diagnóstico , Doença de Alzheimer/complicações , Lipidômica , Disfunção Cognitiva/etiologia , Lipídeos , Progressão da Doença , Biomarcadores
2.
Biomacromolecules ; 24(7): 3397-3410, 2023 07 10.
Artigo em Inglês | MEDLINE | ID: mdl-37379247

RESUMO

Bacterial infection, prolonged inflammation, and insufficient angiogenesis are the main challenges for effective wound repair. In this work, we developed a stretchable, remodeling, self-healing, and antibacterial multifunctional composite hydrogel for infected wound healing. The hydrogel was prepared using tannic acid (TA) and phenylboronic acid-modified gelatin (Gel-BA) through hydrogen bonding and borate ester bonds and incorporated iron-containing bioactive glasses (Fe-BGs) with uniform spherical morphologies and amorphous structures to achieve GTB composite hydrogels. On one hand, the chelation of Fe3+ in Fe-BGs with TA endowed the hydrogel with good photothermal synergistic antibacterial ability; on the other hand, the bioactive Fe3+ and Si ions contained in Fe-BGs can recruit cells and synergistically promote blood vessel formation. In vivo animal experiments showed that the GTB hydrogels remarkably accelerated infected full-thickness skin wound healing by improving granulation tissue formation, collagen deposition, and the formation of nerves and blood vessels while decreasing inflammation. This hydrogel with a dual synergistic effect and ″one stone, two birds″ strategy holds immense potential for wound dressing applications.


Assuntos
Gelatina , Hidrogéis , Animais , Gelatina/farmacologia , Hidrogéis/farmacologia , Antibacterianos/farmacologia , Bandagens , Boratos
3.
Anticancer Drugs ; 33(4): 371-383, 2022 04 01.
Artigo em Inglês | MEDLINE | ID: mdl-35213857

RESUMO

Lung adenocarcinoma (LUAD) has a high mortality rate. N6-methyl-adenosine (m6A)-related long noncoding RNA (lncRNA) is associated with tumor prognosis. Our objective was to construct an m6A-related lncRNA prognostic model and screen potential drugs for the treatment of LUAD. The LUAD sequencing data were randomly divided into Train and Test cohorts. In the Train group, the LASSO Cox regression was used to construct the m6A-related lncRNA prognostic model. The LUAD tumor immune dysfunction and exclusion model was used to evaluate immunotherapy efficacy in LUAD. The 'pRRophetic' package was utilized to screen potential drugs for the treatment of LUAD. Eleven m6A-related lncRNAs were identified by LASSO Cox regression and were used to construct the risk model to calculate sample risk scores. Patients were divided into high- and low-risk groups based on their median risk scores. The LUAD data of The Cancer Genome Atlas database showed that the overall survival (OS) of the high-risk group was significantly lower than that of the low-risk group in both cohorts. Multivariate Cox regression analysis showed that this risk model could serve as an independent prognostic factor of LUAD, and receiver operating characteristic curves suggested that m6A-related lncRNA prognostic signature has a good ability in predicting OS. Finally, nine potential drugs for LUAD treatment were screened based on this prognostic model. The prognostic model constructed based on the m6A-related lncRNAs facilitated prognosis prediction in LUAD patients. The screened therapeutic agents have potential application values and provide a reference for the clinical treatment of LUAD.


Assuntos
Adenocarcinoma , RNA Longo não Codificante , Adenosina , Humanos , Pulmão , Prognóstico , RNA Longo não Codificante/genética
4.
BMC Pulm Med ; 22(1): 412, 2022 Nov 10.
Artigo em Inglês | MEDLINE | ID: mdl-36357869

RESUMO

BACKGROUND: Adenocarcinoma has long been an independent histological class of lung cancer, which leads to high morbidity and mortality. We aimed to investigate the contribution of LINC02126 in lung adenocarcinoma. METHODS: RNA sequencing data and clinical information were downloaded. Diagnostic efficiency and survival analysis of LINC02126 were performed, followed by functional analysis of genes co-expressed with LINC02126 and differentially expressed genes (DEGs) in different LINC02126 expression groups. Tumor immune microenvironment (TIME) cell infiltration and correlation analysis of tumor mutation burden were performed in different LINC02126 expression groups. RESULTS: In lung adenocarcinoma, the expression level of LINC02126 was significantly decreased. Significant expression differences of LINC02126 were found in some clinical variables, including T staging, M staging, sex, stage, and EGFR mutation. LINC02126 had potential diagnostic and prognostic value for patients. In the low LINC02126 expression group, the infiltration degree of most immune cells was significantly lower than that in the high LINC02126 expression group. Tumor mutation burden level and frequency of somatic mutation in patients with low LINC02126 expression group were significantly higher than in patients with high LINC02126 expression group. CONCLUSIONS: LINC02126 could be considered as a diagnostic, prognostic and immunotherapeutic target for lung adenocarcinoma.


Assuntos
Adenocarcinoma de Pulmão , Neoplasias Pulmonares , Humanos , Prognóstico , Receptores ErbB/genética , Adenocarcinoma de Pulmão/diagnóstico , Adenocarcinoma de Pulmão/genética , Neoplasias Pulmonares/diagnóstico , Neoplasias Pulmonares/genética , Biomarcadores Tumorais/genética , Biomarcadores Tumorais/metabolismo , Imunoterapia , Regulação Neoplásica da Expressão Gênica , Microambiente Tumoral/genética
5.
Cancer Cell Int ; 21(1): 7, 2021 Jan 06.
Artigo em Inglês | MEDLINE | ID: mdl-33407453

RESUMO

BACKGROUND: LncRNA was known to be closely associated with the progression of human tumors. The role of lncRNA LIFR-AS1 in the pathogenesis and progression of gastric tumor is still unclear. The aim of this study was to investigate the function of LIFR-AS1 and the underlying mechanism in the pathogenesis and progression of gastric cancer. METHODS: QRT-PCR was used to evaluate the expression of LIFR-AS1, miR-29a-3p and COL1A2 in gastric tumor tissues and cells. Western blotting was used to evaluate the protein expression of COL1A2 in gastric tumor cells. CCK-8 assay, transwell assay and flow cytometry were used to evaluate the roles of LIFR-AS1, miR-29a-3p and COL1A2 in cell proliferation, invasion, migration and apoptosis. The relationship among LIFR-AS1, miR-29a-3p and COL1A2 was assessed by bioinformatics analyses and luciferase reporter assay. RESULTS: The expression levels of LIFR-AS1 were significantly increased in gastric tumor tissues and cells, while the expression levels of miR-29a-3p were decreased. The expression of miR-29a-3p was negatively correlated with the expression of LIFR-AS1 in gastric cancer tumor tissues. Knocking down of LIFR-AS1 inhibited proliferation, invasion and migration of gastric tumor cells, and induced apoptosis of gastric tumor cells. Bioinformatics analyses and integrated experiments revealed that LIFR-AS1 elevated the expression of COL1A2 through sponging miR-29a-3p, which further resulted in the progression of gastric tumor. CONCLUSION: LIFR-AS1 plays an important role as a competing endogenous RNA in gastric tumor pathogenesis and may be a potential target for the diagnosis and treatment of gastric tumor.

6.
BMC Neurol ; 20(1): 423, 2020 Nov 23.
Artigo em Inglês | MEDLINE | ID: mdl-33225927

RESUMO

BACKGROUND: Transient ischemic attack (TIA) is a brief episode of cerebral ischemia. However, if a symptom is not presented as drop attack or hemiplegia, and alarming to the patient and the physician, how short of a symptom duration would raise the concern of a physician for TIA? It will be more complicated if the location of the neurological deficit is vagrant. This report highlights a rare TIA case which presented a very short duration of migratory patchy distribution numbness. CASE PRESENTATION: A middle-aged gentleman was presented with recurrent patchy distribution numbness on the right side of the body for 2 months, with the episode lasting as short as about 10 s. The location of the numbness was erratic and migratory. Magnetic resonance angiography (MRA) revealed mild stenosis on the left middle cerebral artery (MCA). Transcranial Doppler (TCD) micro-emboli monitoring detected positive micro-emboli signals (MES), leading to the confirmation of a TIA diagnosis. After a standard dual antiplatelet treatment combined with enhanced lipid reduction therapy with statins, MES disappeared on dynamic TCD emboli monitoring, and no more episodes of TIA have been noticed on the follow-ups. CONCLUSION: TIA caused by micro-emboli can display as recurrent migratory neurological deficit within seconds. TCD micro-emboli monitoring is very helpful to differentiate this situation from TIA mimics with follow-ups, as well as to locate unstable plague.


Assuntos
Hipestesia/etiologia , Embolia Intracraniana/complicações , Embolia Intracraniana/diagnóstico por imagem , Ataque Isquêmico Transitório/diagnóstico por imagem , Ataque Isquêmico Transitório/etiologia , Ultrassonografia Doppler Transcraniana/métodos , Humanos , Angiografia por Ressonância Magnética , Masculino , Pessoa de Meia-Idade
7.
Inorg Chem ; 59(9): 6518-6527, 2020 May 04.
Artigo em Inglês | MEDLINE | ID: mdl-32298101

RESUMO

Putting different metal clusters into the fullerene cages form the so-called "endohedral clusterfullerenes" (ECFs), among which all the carbonitride ECFs feature a common NC unit coordinating with either one or three metal atoms. Unfortunately, their internal N and C atoms are difficult to be distinguished experimentally, resulting in the fact that the exact structure and bonding nature of the encased metal cluster still remain unclear thus far. In this work, density functional theory calculations were performed for several representative carbonitride ECFs: MNC@C2n (M = Y, Tb; 2n = 76, 82) and Sc3CN@C2n (2n = 78, 80). For the first time, we focused on the C ↔ N interchange inside the cages and its effect on the chemical bonding of the trapped clusters. Computational results reveal that the two types of ECFs energetically favor the N and C atoms at the cluster center, respectively. The preference can be interpreted by the difference in several aspects, such as the energy of isolated clusters, charge states of (CN)-/3-, and cluster-cage interactions, as well as hyperconjugation of the internal clusters. The detailed wave function analyses indicate that MNC@C2n and Sc3CN@C2n bear a C≡N triple bond and a C═N double bond, respectively, regardless of the NC orientation. Compared with its slightly influence on the bonding patterns of the encaged MNC clusters, the C ↔ N interchange dramatically affects that of the Sc3CN units involving two-center two-electron (2c-2e) bonds, undiscovered three-center two-electron (3c-2e), and four-center two-electron (4c-2e) bonds.

8.
Inorg Chem ; 59(10): 7039-7048, 2020 May 18.
Artigo em Inglês | MEDLINE | ID: mdl-32343133

RESUMO

Endohedral clusterfullerenes (ECFs) are fullerene cages with various metallic clusters trapped inside. So far, the actinide-based ECFs are rather scarce with their possible structures and chemistry remaining largely unexplored. Herein, density functional theory calculations characterized that the recently synthesized U2O@C76 could be U2O@Cs(17 490)-C76 or U2O@C2v(19 138)-C76, whose cages have two or one pentagon adjacencies (PAs) and thus both violate the isolated pentagon rule (IPR). It is noteworthy that they are the first actinide-based ECFs bearing non-IPR outer cages. They are also the first Cs(17 490)- and C2v(19 138)-C76-based oxide ECFs. Moreover, U2O@C2v(19 138)-C76 is the first example of a hexavalent metal cluster within the C2v(19 138)-C76 cage. Interestingly, although trapped by the two same-sized cages, the U2O unit exhibits a bent and a perfect linear configuration, respectively, indicative of the crucial role of cage shape in steering the internal cluster configuration. Their electronic structures can be formally described as (U2O)6+@C766- with primary electrostatic attractions and secondary covalent interactions between cluster and cage. Significantly, bonding analyses reveal that the encaged U2O moiety may only features two three-center, two-electron (3c-2e) U-O-U bonds with completely absent common two-center bonds.

9.
J Phys Chem A ; 124(13): 2694-2699, 2020 Apr 02.
Artigo em Inglês | MEDLINE | ID: mdl-32167770

RESUMO

The stability of endohedral clusterfullerenes is generally understood in terms of the metal cluster shape, cage structure, and metal-cage interactions, with the electronic state of the internal cluster mostly neglected. Herein, theoretical calculations reveal that the (Ti3C3)6+ unit of recently synthesized Ti3C3@Ih(7)-C80 exhibits a superatomic state with a perfect closed-shell 1S21P61D10 electronic configuration in accordance with the famous jellium model. This "trapped superatom" features considerable aromaticity and hyperconjugation interactions never reported for other clusterfullerenes. Besides the localized two-center two-electron (2c-2e) Ti-C/C-C bonds, it also has two 3c-2e Ti-C-Ti bonds. Furthermore, the ring strain of the cyclopropane-like C3 core is effectively released upon the metal coordination. All these factors greatly stabilize the (Ti3C3)6+ cluster, showing the critical role of metal-to-cage charge transfer and cage encapsulation in enhancing the stability of this exotic metal cluster.

10.
J Med Internet Res ; 22(9): e22457, 2020 09 29.
Artigo em Inglês | MEDLINE | ID: mdl-32924947

RESUMO

BACKGROUND: Maintaining compliance with personal preventive measures is important to achieve a balance of COVID-19 pandemic control and work resumption. OBJECTIVE: The aim of this study was to investigate self-reported compliance with four personal measures to prevent COVID-19 among a sample of factory workers in Shenzhen, China, at the beginning of work resumption in China following the COVID-19 outbreak. These preventive measures included consistent wearing of face masks in public spaces (the workplace and other public settings); sanitizing hands using soap, liquid soap, or alcohol-based hand sanitizer after returning from public spaces or touching public installations and equipment; avoiding social and meal gatherings; and avoiding crowded places. METHODS: The participants were adult factory workers who had resumed work in Shenzhen, China. A stratified two-stage cluster sampling design was used. We randomly selected 14 factories that had resumed work. All full-time employees aged ≥18 years who had resumed work in these factories were invited to complete a web-based survey. Out of 4158 workers who had resumed work in these factories, 3035 (73.0%) completed the web-based survey from March 1 to 14, 2020. Multilevel logistic regression models were fitted. RESULTS: Among the 3035 participants, 2938 (96.8%) and 2996 (98.7%) reported always wearing a face mask in the workplace and in other public settings, respectively, in the past month. However, frequencies of self-reported sanitizing hands (2152/3035, 70.9%), avoiding social and meal gatherings (2225/3035, 73.3%), and avoiding crowded places (1997/3035, 65.8%) were relatively low. At the individual level, knowledge about COVID-19 (adjusted odds ratios [AORs] from 1.16, CI 1.10-1.24, to 1.29, CI 1.21-1.37), perceived risk (AORs from 0.58, CI 0.50-0.68, to 0.85, CI 0.72-0.99) and severity (AOR 1.05, CI 1.01-1.09, and AOR 1.07, CI 1.03-1.11) of COVID-19, perceived effectiveness of preventive measures by the individual (AORs from 1.05, CI 1.00-1.10, to 1.09, CI 1.04-1.13), organization (AOR 1.30, CI 1.20-1.41), and government (AORs from 1.14, CI 1.04-1.25, to 1.21, CI 1.02-1.42), perceived preparedness for a potential outbreak after work resumption (AORs from 1.10, CI 1.00-1.21, to 1.50, CI 1.36-1.64), and depressive symptoms (AORs from 0.93, CI 0.91-0.94, to 0.96, CI 0.92-0.99) were associated with self-reported compliance with at least one personal preventive measure. At the interpersonal level, exposure to COVID-19-specific information through official media channels (AOR 1.08, CI 1.04-1.11) and face-to-face communication (AOR 0.90, CI 0.83-0.98) were associated with self-reported sanitizing of hands. The number of preventive measures implemented in the workplace was positively associated with self-reported compliance with all four preventive measures (AORs from 1.30, CI 1.08-1.57, to 1.63, CI 1.45-1.84). CONCLUSIONS: Measures are needed to strengthen hand hygiene and physical distancing among factory workers to reduce transmission following work resumption. Future programs in workplaces should address these factors at multiple levels.


Assuntos
Infecções por Coronavirus/epidemiologia , Infecções por Coronavirus/prevenção & controle , Emprego/estatística & dados numéricos , Inquéritos Epidemiológicos , Controle de Infecções/estatística & dados numéricos , Saúde Ocupacional/estatística & dados numéricos , Pandemias/prevenção & controle , Pneumonia Viral/epidemiologia , Pneumonia Viral/prevenção & controle , Autorrelato , Local de Trabalho , Adulto , Betacoronavirus , COVID-19 , China/epidemiologia , Infecções por Coronavirus/transmissão , Estudos Transversais , Surtos de Doenças , Feminino , Humanos , Controle de Infecções/métodos , Masculino , Saúde Ocupacional/normas , Razão de Chances , Pneumonia Viral/transmissão , SARS-CoV-2 , Adulto Jovem
11.
Inorg Chem ; 58(16): 10648-10655, 2019 Aug 19.
Artigo em Inglês | MEDLINE | ID: mdl-31348657

RESUMO

Stimulated by the recent successful synthesis and crystallographic characterization of the first diuranium carbide endohedral metallofullerene (EMF) U2C@Ih(7)-C80 ( Zhang et al. Nat. Commun. ; 2018 ), density functional theory calculations were performed for a series of U2C@C2n (2n = 60, 68, 72, 78, 80, 88, 96, and 104) analogues. The internal UCU bond angle increases from 96.9° in Ih-C60 to 180.0° in D3d-C104, exhibiting cage-size-dependent cluster configuration. However, further evidence suggests that the U2C shape may be also affected by the amount of charge transferred from the cluster to the outer cage with 6e and 4e favoring bent and linear, respectively. The change of the bond angle closely correlates with the charge and hybrid state of the internal atom. Significantly, besides the covalent two-center two-electron (2c-2e) U-C bonds, the U2C unit always features two 3c-2e bonds regardless of its size, shape, and charge state. Furthermore, for the cluster-cage interactions, besides the dominated electrostatic attractions, all these EMFs show an obvious covalent character with the substantial participation of U 5f valence orbitals.

12.
Stroke ; 49(9): 2102-2107, 2018 09.
Artigo em Inglês | MEDLINE | ID: mdl-30354992

RESUMO

Background and Purpose- Although perfusion abnormality is an increasingly important therapeutic target, the natural history of tissue at risk without reperfusion treatment is understudied. Our objective was to determine how time affects penumbral salvage and infarct growth in untreated acute ischemic stroke patients and whether collateral status affects this relationship. Methods- We used a prospectively collected, multicenter acute stroke registry to assess acute stroke patients who were not treated with intravenous thrombolysis or endovascular treatment. We analyzed baseline computed tomography angiogram and computed tomography perfusion within 24 hours of stroke onset along with follow-up imaging and assessed time from stroke onset to baseline imaging, ASPECTS (Alberta Stroke Program Early CT Score), vessel occlusion, collaterals, ischemic core, and penumbra. Penumbral salvage and infarct growth were calculated. Correlations between time and penumbral salvage and infarct growth were evaluated with Spearman correlation. Penumbral salvage and infarct growth were compared between subjects with good versus poor collateral status using the Wilcoxon rank-sum test. Clinical and imaging factors affecting penumbral salvage and infarct growth were evaluated by linear regression. Results- Among 94 untreated stroke patients eligible for this analysis, the mean age was 65 years, median National Institutes of Health Stroke Scale score was 13, and median (range) time from stroke onset to baseline imaging was 2.9 (0.4-23) hours. There was no correlation between time and salvaged penumbra ( r=0.06; P=0.56) or infarct growth ( r=-0.05; P=0.61). Infarct growth was higher among those with poor collaterals versus those with good collaterals (median, 52.3 versus 0.9 cm3; P<0.01). Penumbral salvage was lower among those with poor collaterals compared with those with good collaterals (poor, 0 [0-0]; good, 5.9 cm3 [0-29.4]; P<0.01). Multivariable linear regression demonstrated that collaterals, but not time, were significantly associated with infarct growth and penumbral salvage. Conclusions- In this natural history study, penumbral salvage and infarct growth were less time dependent and more a measure of collateral flow.


Assuntos
Infarto Encefálico/diagnóstico por imagem , Circulação Cerebrovascular , Circulação Colateral , Sistema de Registros , Acidente Vascular Cerebral/diagnóstico por imagem , Adulto , Idoso , Idoso de 80 Anos ou mais , Isquemia Encefálica/diagnóstico por imagem , Doenças das Artérias Carótidas/diagnóstico por imagem , Artéria Carótida Interna/diagnóstico por imagem , Angiografia por Tomografia Computadorizada , Progressão da Doença , Feminino , Humanos , Infarto da Artéria Cerebral Média/diagnóstico por imagem , Modelos Lineares , Masculino , Pessoa de Meia-Idade , Imagem de Perfusão , Fatores de Tempo , Tomografia Computadorizada por Raios X , Adulto Jovem
13.
Inorg Chem ; 57(12): 7142-7150, 2018 Jun 18.
Artigo em Inglês | MEDLINE | ID: mdl-29808676

RESUMO

Endohedral metallofullerenes (EMFs) containing actinides are rather intriguing due to potential 5f-orbital participation in the metal-metal or metal-cage bonding. In this work, density functional theory calculations first characterized the structure of recently synthesized ThC74 as Th@ D3 h(14246)-C74. We found that the thorium atom adopts an unusual off-axis position inside cage due to small metal ion size and the requirement of large coordination number, which phenomenon was further extended to other Th-based EMFs. Significantly, besides the strong metal-cage electrostatic attractions, topological and orbital analysis revealed that all the investigated Th-based EMFs exhibit obvious covalent interactions between metal and cage with substantial contribution from the Th 5f orbitals. The encapsulation by fullerenes is thus proposed as a practical pathway toward the f-orbital covalency for thorium. Interestingly, the anomalous internal position of Th led to a novel three-dimensional metal trajectory at elevated temperatures in the D3 h-C74 cavity, as elucidated by the static computations and molecular dynamic simulations.

14.
Phys Chem Chem Phys ; 19(27): 17598-17606, 2017 Jul 21.
Artigo em Inglês | MEDLINE | ID: mdl-28657081

RESUMO

We found that the standard B3LYP and dispersion-corrected B3LYP-D3 methods predicted completely opposite energy order for the Lewis acid-base adducts formed by Ih-C60 or D5h-C70 with normal C2-bound (nNHC) and abnormal C5-bound (aNHC) N-heterocyclic carbenes. By using the validated B3LYP-D3 method and taking the solvent effects into account, the exclusive formations of the nNHC-C60/70 (Li et al. J. Am. Chem. Soc., 2011, 133, 12410-12413) and aNHC-Sc3N@Ih-C80 complexes (Chen et al. Chem. Sci., 2016, 7, 2331-2334) in two recent experiments were suggested to be thermodynamically and kinetically controlled, respectively. In contrast to the reported reactions of endohedral metallofullerenes, aNHC-Sc3N@Ih-C80 hardly isomerizes to the low-energy normal adducts under heat treatment probably due to the substantial energy barrier and excess NHC reagent used in the experiment. Furthermore, the highly regioselective addition of aNHC to the triple-hexagon-junction carbon atom of Sc3N@Ih-C80 was rationalized by using the frontier molecular orbital theory.

15.
Phys Chem Chem Phys ; 18(31): 21398-411, 2016 Aug 03.
Artigo em Inglês | MEDLINE | ID: mdl-27424658

RESUMO

As the first study on metal carbide/cyanide boron clusterfullerenes, the geometries, energies, stabilities and electronic properties of four novel scandium cluster-containing B80 buckyball derivatives, namely Sc2C2@B80, Sc3C2@B80, Sc3CN@B80 and Sc3C2CN@B80, were investigated by means of density functional theory computations. The rather favorable binding energies, which are very close to those of the experimentally abundant carbon fullerene analogues, suggest a considerable possibility to realize these doped boron clusterfullerenes. Their intracluster and cluster-cage bonding natures were thoroughly revealed by various theoretical approaches. In contrast to carbon clusterfullerenes, in which the encaged non-metal atoms mainly play a stabilizing role in the metal clusters, the encapsulated carbon and nitrogen atoms inside the B80 cage covalently bond to the boron framework, resulting in strong cluster-cage interactions. Furthermore, infrared spectra and (11)B nuclear magnetic resonance spectra were simulated and fingerprint peaks were proposed to assist future experimental characterization.

16.
Neuroradiology ; 58(11): 1135-1141, 2016 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-27590748

RESUMO

INTRODUCTION: The aims of the study were to compare the diagnostic performance of a combination of virtual non-contrast (VNC) images and arterial images obtained from a single-phase dual-energy CT (DECT) acquisition and standard non-contrast and arterial images from a biphasic protocol and to study the potential radiation dose reduction of the former approach. METHODS: All DECT examinations performed for evaluation of parathyroid adenomas during a 13-month period were retrospectively reviewed. An initial single-energy unenhanced acquisition was followed by a dual-energy arterial phase acquisition. "Virtual non-contrast images" were generated from the dual-energy acquisition. Two independent and blinded radiologists evaluated three different sets of images during three reading sessions: single arterial phase, single-phase DECT (virtual non-contrast and arterial phase), and standard biphasic protocol (true non-contrast and arterial phase). The accuracy of interpretation in lateralizing an adenoma to the side of the neck and localizing it to a quadrant in the neck was evaluated. RESULTS: Sixty patients (mean age, 65.5 years; age range, 38-87 years) were included in the study. The lateralization and localization accuracy, sensitivity, and positive predicted value (PPV) and negative predicted value (NPV) of the different image datasets were comparable. The combination of VNC and arterial images was more specific than arterial images alone to lateralize a parathyroid lesion (OR = 1.93, p = 0.043). The use of the single-phase protocol resulted in a calculated radiation exposure reduction of 52.8 %. CONCLUSIONS: Virtual non-contrast and arterial images from a single DECT acquisition showed similar diagnostic accuracy than a biphasic protocol, providing a significant dose reduction.


Assuntos
Adenoma/diagnóstico por imagem , Interpretação de Imagem Assistida por Computador/métodos , Neoplasias das Paratireoides/diagnóstico por imagem , Exposição à Radiação/análise , Exposição à Radiação/prevenção & controle , Proteção Radiológica/métodos , Imagem Radiográfica a Partir de Emissão de Duplo Fóton/métodos , Adulto , Idoso , Idoso de 80 Anos ou mais , Feminino , Humanos , Masculino , Pessoa de Meia-Idade , Doses de Radiação , Reprodutibilidade dos Testes , Sensibilidade e Especificidade
18.
Neuroradiology ; 57(6): 573-81, 2015 Jun.
Artigo em Inglês | MEDLINE | ID: mdl-25749851

RESUMO

INTRODUCTION: Perfusion-CT (PCT) processing involves deconvolution, a mathematical operation that computes the perfusion parameters from the PCT time density curves and an arterial curve. Delay-sensitive deconvolution does not correct for arrival delay of contrast, whereas delay-insensitive deconvolution does. The goal of this study was to compare delay-sensitive and delay-insensitive deconvolution PCT in terms of delineation of the ischemic core and penumbra. METHODS: We retrospectively identified 100 patients with acute ischemic stroke who underwent admission PCT and CT angiography (CTA), a follow-up vascular study to determine recanalization status, and a follow-up noncontrast head CT (NCT) or MRI to calculate final infarct volume. PCT datasets were processed twice, once using delay-sensitive deconvolution and once using delay-insensitive deconvolution. Regions of interest (ROIs) were drawn, and cerebral blood flow (CBF), cerebral blood volume (CBV), and mean transit time (MTT) in these ROIs were recorded and compared. Volume and geographic distribution of ischemic core and penumbra using both deconvolution methods were also recorded and compared. RESULTS: MTT and CBF values are affected by the deconvolution method used (p < 0.05), while CBV values remain unchanged. Optimal thresholds to delineate ischemic core and penumbra are different for delay-sensitive (145 % MTT, CBV 2 ml × 100 g(-1) × min(-1)) and delay-insensitive deconvolution (135 % MTT, CBV 2 ml × 100 g(-1) × min(-1) for delay-insensitive deconvolution). When applying these different thresholds, however, the predicted ischemic core (p = 0.366) and penumbra (p = 0.405) were similar with both methods. CONCLUSION: Both delay-sensitive and delay-insensitive deconvolution methods are appropriate for PCT processing in acute ischemic stroke patients. The predicted ischemic core and penumbra are similar with both methods when using different sets of thresholds, specific for each deconvolution method.


Assuntos
Isquemia Encefálica/diagnóstico por imagem , Meios de Contraste , Imagem de Perfusão , Acidente Vascular Cerebral/diagnóstico por imagem , Tomografia Computadorizada por Raios X , Adolescente , Adulto , Idoso , Idoso de 80 Anos ou mais , Isquemia Encefálica/complicações , Angiografia Cerebral , Circulação Cerebrovascular , Feminino , Humanos , Imageamento por Ressonância Magnética , Masculino , Pessoa de Meia-Idade , Estudos Retrospectivos , Acidente Vascular Cerebral/etiologia , Adulto Jovem
19.
Stroke ; 45(12): 3597-605, 2014 Dec.
Artigo em Inglês | MEDLINE | ID: mdl-25388419

RESUMO

BACKGROUND AND PURPOSE: Although arteriopathies are the most common cause of childhood arterial ischemic stroke, and the strongest predictor of recurrent stroke, they are difficult to diagnose. We studied the role of clinical data and follow-up imaging in diagnosing cerebral and cervical arteriopathy in children with arterial ischemic stroke. METHODS: Vascular effects of infection in pediatric stroke, an international prospective study, enrolled 355 cases of arterial ischemic stroke (age, 29 days to 18 years) at 39 centers. A neuroradiologist and stroke neurologist independently reviewed vascular imaging of the brain (mandatory for inclusion) and neck to establish a diagnosis of arteriopathy (definite, possible, or absent) in 3 steps: (1) baseline imaging alone; (2) plus clinical data; (3) plus follow-up imaging. A 4-person committee, including a second neuroradiologist and stroke neurologist, adjudicated disagreements. Using the final diagnosis as the gold standard, we calculated the sensitivity and specificity of each step. RESULTS: Cases were aged median 7.6 years (interquartile range, 2.8-14 years); 56% boys. The majority (52%) was previously healthy; 41% had follow-up vascular imaging. Only 56 (16%) required adjudication. The gold standard diagnosis was definite arteriopathy in 127 (36%), possible in 34 (9.6%), and absent in 194 (55%). Sensitivity was 79% at step 1, 90% at step 2, and 94% at step 3; specificity was high throughout (99%, 100%, and 100%), as was agreement between reviewers (κ=0.77, 0.81, and 0.78). CONCLUSIONS: Clinical data and follow-up imaging help, yet uncertainty in the diagnosis of childhood arteriopathy remains. This presents a challenge to better understanding the mechanisms underlying these arteriopathies and designing strategies for prevention of childhood arterial ischemic stroke.


Assuntos
Artérias/patologia , Acidente Vascular Cerebral/etiologia , Doenças Vasculares/complicações , Doenças Vasculares/diagnóstico , Adolescente , Criança , Pré-Escolar , Feminino , Humanos , Lactente , Recém-Nascido , Imageamento por Ressonância Magnética , Masculino
20.
Neurosurg Focus ; 36(1): E3, 2014 Jan.
Artigo em Inglês | MEDLINE | ID: mdl-24380480

RESUMO

Neuroimaging has expanded beyond its traditional diagnostic role and become a critical tool in the evaluation and management of stroke. The objectives of imaging include prompt accurate diagnosis, treatment triage, prognosis prediction, and secondary preventative precautions. While capitalizing on the latest treatment options and expanding upon the "time is brain" doctrine, the ultimate goal of imaging is to maximize the number of treated patients and improve the outcome of one the most costly and morbid disease. A broad overview of comprehensive multimodal stroke imaging is presented here to affirm its utilization.


Assuntos
Isquemia Encefálica/diagnóstico , Neuroimagem/métodos , Acidente Vascular Cerebral/diagnóstico , Isquemia Encefálica/patologia , Isquemia Encefálica/cirurgia , Revascularização Cerebral , Circulação Colateral , Diagnóstico Diferencial , Procedimentos Endovasculares/métodos , Humanos , Processamento de Imagem Assistida por Computador , Hemorragias Intracranianas/diagnóstico , Hemorragias Intracranianas/patologia , Ataque Isquêmico Transitório/diagnóstico , Ataque Isquêmico Transitório/patologia , Ataque Isquêmico Transitório/cirurgia , Imageamento por Ressonância Magnética , Acidente Vascular Cerebral/patologia , Acidente Vascular Cerebral/cirurgia , Terapia Trombolítica , Tomografia Computadorizada por Raios X
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