165 research outputs found
On the role of physisorption states in molecular scattering: A semi-local density-functional theory study on O2/Ag(111)
We simulate the scattering of O from Ag(111) with classical dynamics
simulations performed on a six-dimensional potential energy surface calculated
within semi-local density-functional theory (DFT). The enigmatic experimental
trends that originally required the conjecture of two types of repulsive walls,
arising from a physisorption and chemisorption part of the interaction
potential, are fully reproduced. Given the inadequate description of the
physisorption properties in semi-local DFT, our work casts severe doubts on the
prevalent notion to use molecular scattering data as indirect evidence for the
existence of such states.Comment: 5 pages, 4 figure
Trasplante pulmonar
A lung transplant is usually the final therapeutic
option for patients with respiratory insufficiency. In
spite of the many advances in immunology and the
management of complications, mortality and morbidity
associated with this transplant are far higher than
with others. Acute rejection is an almost universal
problem in the first year, while obliterative bronchitis
reduces long term survival. Respiratory infections
also play a significant role in the complications associated
with lung transplants due to the constant
exposure of the graft to the outside. However, the
success of this therapeutic option, which basically
depends on a suitable selection of donor and recipient,
are evident, above all with respect to quality of
life
Producción de látex híbridos acrílicos/alquídicos
In this work, the production of high solids content hybrid acrylic/alkyd latexes by miniemulsion polymerization is discussed. First, the miniemulsification procedure to achieve colloidally stable hybrid nanodroplets is presented. Next, the efficient nucleation of most nanodroplets during the polymerization, avoiding other nucleation mechanisms is presented. Finally, the key aspects to control the polymer architecture as well as the particle morphology are analyzed.Fil: Goikoetxea, Monika. Universidad del País Vasco; EspañaFil: Minari, Roque Javier. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe. Instituto de Desarrollo Tecnológico para la Industria Química. Universidad Nacional del Litoral. Instituto de Desarrollo Tecnológico para la Industria Química; ArgentinaFil: Beristain, Itxaso. Universidad del País Vasco; EspañaFil: Paulis, María. Universidad del País Vasco; EspañaFil: Asua, José M.. Universidad del País Vasco; EspañaFil: Barandiaran, María J.. Universidad del País Vasco; Españ
Estudio por teledetección de las entradas de polvo sahariano al océano y su posible influencia sobre la productividad marina en el área macaronésica
Ponencia presentada en: 1er Encuentro sobre Meteorología y Atmósfera de Canarias, celebrado en el Puerto de la Cruz, los días 12,13 y 14 de noviembre de 2003. El encuentro estuvo organizado por el Centro Meteorológico Territorial en Canarias Occidental, con la colaboración del Observatorio Atmosférico de Izaña y del Grupo de Física de la Atmósfera de la Facultad de Física (Universidad de La Laguna
Asynchronous Training of Word Embeddings for Large Text Corpora
Word embeddings are a powerful approach for analyzing language and have been
widely popular in numerous tasks in information retrieval and text mining.
Training embeddings over huge corpora is computationally expensive because the
input is typically sequentially processed and parameters are synchronously
updated. Distributed architectures for asynchronous training that have been
proposed either focus on scaling vocabulary sizes and dimensionality or suffer
from expensive synchronization latencies.
In this paper, we propose a scalable approach to train word embeddings by
partitioning the input space instead in order to scale to massive text corpora
while not sacrificing the performance of the embeddings. Our training procedure
does not involve any parameter synchronization except a final sub-model merge
phase that typically executes in a few minutes. Our distributed training scales
seamlessly to large corpus sizes and we get comparable and sometimes even up to
45% performance improvement in a variety of NLP benchmarks using models trained
by our distributed procedure which requires of the time taken by the
baseline approach. Finally we also show that we are robust to missing words in
sub-models and are able to effectively reconstruct word representations.Comment: This paper contains 9 pages and has been accepted in the WSDM201
Non-adiabatic effects during the dissociative adsorption of O2 at Ag(111)? A first-principles divide and conquer study
We study the gas-surface dynamics of O2 at Ag(111) with the particular
objective to unravel whether electronic non-adiabatic effects are contributing
to the experimentally established inertness of the surface with respect to
oxygen uptake. We employ a first-principles divide and conquer approach based
on an extensive density-functional theory mapping of the adiabatic potential
energy surface (PES) along the six O2 molecular degrees of freedom. Neural
networks are subsequently used to interpolate this grid data to a continuous
representation. The low computational cost with which forces are available from
this PES representation allows then for a sufficiently large number of
molecular dynamics trajectories to quantitatively determine the very low
initial dissociative sticking coefficient at this surface. Already these
adiabatic calculations yield dissociation probabilities close to the scattered
experimental data. Our analysis shows that this low reactivity is governed by
large energy barriers in excess of 1.1 eV very close to the surface.
Unfortunately, these adiabatic PES characteristics render the dissociative
sticking a rather insensitive quantity with respect to a potential spin or
charge non-adiabaticity in the O2-Ag(111) interaction. We correspondingly
attribute the remaining deviations between the computed and measured
dissociation probabilities primarily to unresolved experimental issues with
respect to surface imperfections.Comment: 18 pages including 6 figure
Altered cardiac expression of peroxisome proliferator-activated receptor-isoforms in patients with hypertensive heart disease
OBJECTIVE: To investigate whether cardiac expression of the nuclear peroxisome proliferator-activated receptor alpha (PPARalpha) is altered in patients with hypertensive heart disease (HHD).
METHODS: We studied endomyocardial septal biopsies from 24 patients with essential hypertension divided into three groups: 6 without left ventricular hypertrophy (LVH) (HT group), 10 with LVH (LVH group), and 8 with LVH and heart failure (HF) (HF group). The expression of two PPARalpha isoforms (the native active and the truncated inhibitory) was analyzed by Western blot and reverse transcription polymerase chain reaction (RT-PCR), and two PPARalpha target genes were evaluated by RT-PCR. Histomorphological features were evaluated in a second myocardial sample from LVH and HF groups.
RESULTS: Whereas the expression of native PPARalpha protein was lower (p<0.05) in LVH and HF groups than in the HT group, truncated PPARalpha protein was overexpressed (p<0.001) in the HF group as compared with LVH and HT groups. The mRNA expression of native and truncated PPARalpha was similar in the three groups of hypertensives. In addition, a progressive decrease (p for trend<0.05) in the two PPARalpha target genes mRNA expression was observed among HT, LVH and HF groups. The amount of truncated PPARalpha protein correlates directly with cardiomyocytes apoptosis and inversely with cardiomyocytes density in patients with HHD. In addition, the expression of truncated PPARalpha protein was directly correlated with left ventricular volumes, and inversely with ejection fraction in all hypertensives.
CONCLUSIONS: These findings suggest that post-transcriptional regulation of PPARalpha isoforms is altered in patients with HHD, namely in those developing HF. An excess of the truncated inhibitory isoform may be involved in hypertensive left ventricular failure and remodeling
Differences in Linear Epitopes of Ara h 9 Recognition in Peanut Allergic and Tolerant, Peach Allergic Patients
BackgroundPeanut-allergic patients from the Mediterranean region are predominantly sensitized to the lipid transfer protein (LTP) Ara h 9, and the peach LTP Pru p 3 seems to be the primary sensitizer. However, LTP sensitization in peanut allergy is not a predictive marker for clinically relevant symptoms.ObjectiveWe aimed to identify sequential epitopes of IgE and IgG4 from Pru p 3 and Ara h 9 in peach-allergic patients sensitized to peanuts. We also sought to determine the differences in IgE and IgG4 binding between patients who had developed peanut allergy and those tolerating peanuts.MethodsA total of 46 peach-allergic patients sensitized to peanuts were selected. A total of 35 patients were allergic to peanuts (peanut-allergic group) and 11 were tolerant to peanuts (peanut-tolerant group). We measured sIgE and sIgG4 in peanut, peach, and their recombinant allergen (Ara h 1, Ara h 2, Ara h 3, Ara h 8, and Ara h 9) with fluorescence enzyme immunoassay. We examined the IgE and IgG4 binding to sequential epitopes using a peptide microarray corresponding to linear sequences of the LTPs Ara h 9 and Pru p 3 with a library of overlapping peptides with a length of 20 amino acids (aa) and an offset of 3 aa.ResultsThe frequency and the intensity of IgE recognition of Ara h 9 and Pru p 3 peptides were higher in the peanut-tolerant group than in the peanut-allergic group. We found four Ara h 9 peptides (p4, p14, p21, and p25) and four Pru p 3 peptides (p1, p3, p21, and p24) with a significantly elevated IgE recognition in peanut-tolerant patients. Only one peptide of Ara h 9 (p4) recognized by IgG4 was significantly elevated in the peanut-tolerant group. The IgG4/IgE ratio of Ara h 9 peptide 4 was significantly higher in peanut-tolerant patients than in peanut-allergic patients, while no significant differences were observed in the IgG4/IgE ratio of this peptide in Pru p 3.ConclusionAlthough we found significant differences in IgE and IgG4 recognition of Ara h 9 and Pru p 3 between peanut-tolerant and peanut-allergic patients (all of whom were allergic to peach), polyclonal IgE peptide recognition of both LTPs was observed in peach-allergic patients tolerating peanuts. However, the IgG4 blocking antibodies against Ara h 9 peptide 4 could provide an explanation for the absence of clinical reactivity in peanut-tolerant peach-allergic patients. Further studies are needed to validate the usefulness of IgG4 antibodies against Ara h 9 peptide 4 for peanut allergy diagnosis
A new rapid desensitization protocol for chemotherapy agents
Background: Desensitization has been used for some decades to treat patients with the allergenic drug when an alternative drug with
similar effi cacy and safety is not available. We present the results from a series of oncology patients desensitized at our hospital during
the last 2 years.
Objective: To assess the effi cacy of a new desensitization protocol in patients allergic to chemotherapy drugs.
Methods: We performed an observational retrospective study of 11 women (6 breast cancer and 5 ovarian cancer) who underwent our
desensitization protocol. Four patients had immediate reactions to carboplatin, 3 to docetaxel, 3 to paclitaxel, and 1 to both docetaxel
and paclitaxel. Premedication was administered in all cases. A 5-step protocol based on 5 different dilutions of the drugs was used.
Results: We performed 39 desensitization procedures: 14 to carboplatin, 3 to oxaliplatin, 16 to docetaxel, and 6 to paclitaxel. Eight patients
tolerated the full dose in 36 procedures. One patient suffered an anaphylactic reaction to carboplatin that reverted with treatment. One
patient had dyspnea after a paclitaxel cycle. One patient experienced dyspnea due to chronic pulmonary thromboembolism related to
her disease.
Conclusion: Desensitization is a useful procedure in patients who are allergic to their chemotherapy agents
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