A molecular dynamics model to measure forces between cellulose fibril surfaces: on the effect of non-covalent polyelectrolyte adsorption

This study describes the development of representative models of cellulose fibril surface (CFS) as a first approximation to the study of the molecular interactions that are developed between cellulose fibres. In order to assess its sensitivity and representativeness towards the main factors affecting the bonding properties at the fibre scale, these models were non-covalently surface modified with two types of polyelectrolytes, sodium carboxymethyl cellulose (CMC–ONa) and a cationic polyacrylamide (CPAM). From the analysis of pair correlation functions (g(r)) it was possible to assess the main interactions of adsorption of polyelectrolytes towards the (1–10) hydrophilic cellulose, which were due to electrostatic interactions coupled with hydrogen bonding. Besides, the bond strength between fibril surfaces through the (100) hydrophobic surface was calculated from pull out simulations (using steered molecular dynamics). Using a rate of change of force of 0.159 nN ps-1, the calculated bond strength for the neat CFS model (nanometer scale) was two to three orders of magnitude higher than the experimental values observed at the fibre scale (micrometer scale). The results for the polyelectrolyte modified setups supported the validity of the CFS models to reproduce the expected behavior of inter-fibre joints in terms of the specific bond strength and the relative bonded area at the fibre scale in cellulose materials, and thereby the CFS models are a suitable complement, in conjunction with other techniques, for the systematic study of the effect (in qualitative terms) of chemical or physical factors on the bond strength properties of cellulosic materials. Graphical abstract: [Figure not available: see fulltext.]

Controls on space–time distribution of soft-sediment deformation structures: Applying palaeomagnetic dating to approach the apparent recurrence period of paleoseisms at the Concud Fault (eastern Spain)

This work describes soft-sediment deformation structures (clastic dykes, load structures, diapirs, slumps, nodulizations or mudcracks) identified in three sections (Concud, Ramblillas and Masada Cociero) in the Iberian Range, Spain. These sections were logged from boreholes and outcrops in Upper Pliocene-Lower Pleistocene deposits of the Teruel-Concud Residual Basin, close to de Concud normal fault. Timing of the succession and hence of seismic and non-seismic SSDSs, covering a time span between ~ 3.6 and ~ 1.9 Ma, has been constrained from previous biostratigraphic and magnetostratigraphic information, then substantially refined from a new magnetostratigraphic study at Masada Cociero profile. Non-seismic SSDSs are relatively well-correlated between sections, while seismic ones are poorly correlated except for several clusters of structures. Between 29 and 35 seismic deformed levels have been computed for the overall stratigraphic succession. Factors controlling the lateral and vertical distribution of SSDSs are their seismic or non-seismic origin, the distance to the seismogenic source (Concud Fault), the sedimentary facies involved in deformation and the observation conditions (borehole core vs. natural outcrop). In the overall stratigraphic section, seismites show an apparent recurrence period of 56 to 108 ka. Clustering of seismic SSDSs levels within a 91-ka-long interval records a period of high paleoseismic activity with an apparent recurrence time of 4.8 to 6.1 ka, associated with increasing sedimentation rate and fault activity. Such activity pattern of the Concud Fault for the Late Pliocene-Early Pliocene, with alternating periods of faster and slower slip, is similar to that for the most recent Quaternary (last ca. 74 ka BP). Concerning the research methods, time occurrence patterns recognized for peaks of paleoseismic activity from SSDSs in boreholes are similar to those inferred from primary evidence in trenches. Consequently, apparent recurrence periods calculated from SSDS inventories collected in borehole logs close to seismogenic faults are comparable to actual recurrence times of large paleoearthquakes

Nuevas cartografías temáticas del sector norte de la Fosa de Teruel

La Cuenca de Teruel tiene una dirección N-S y es la mayor estructura extensional intracontinental del Mioceno tardío-Cua- ternario ubicada dentro de la Cadena Ibérica centro-oriental. A pesar de esto, su estudio ha sido algo desigual a lo largo de los años, lo que también se refleja en las cartografías existentes de la cuenca. Los mapas geológicos anteriores a escala de cuenca muestran una carencia en el reconocimiento de las principales estructuras de borde e intracuencales (e.g. Godoy et al., 1983a,b). En este trabajo presentamos un nuevo conjunto de mapas temáticos (geológico, estructural, sedimentario y morfotectónico) del sector norte de la cuenca y su implementación en un espacio de trabajo vectorial, lo que permite un aná- lisis “rápido y fácil” de la fracturación, segmentación estructural, salto vs. distancia y evolución del rifting. La fracturación a escala cartográfica muestra una red de fracturas NE-SW, E-W a ESE-WNW, N-S y NNW-SSE en las rocas mesozoicas del pre-rift, mientras que en los materiales neógenos synrift presentan una dirección N-S dominante en el borde de cuenca pero las principales fallas intracuencales tienen una orientación más diversa (NNE-SSW a NE-SW, E-W o NW-SE). La correlación y los desplazamientos verticales de las sucesivas unidades sedimentarias y de varias superficies de aplanamiento erosivo revelan que la deformación se inició en las fallas del margen, mientras que las fallas intracuencales se desarrollaron principalmente en una etapa posterior. The N-S trending Teruel Basin rift is the largest Late Miocene-Quaternary extensional intracontinental structure located within the central-eastern Iberian Chain. Despite this, its study has been somewhat uneven over the years, which is also reflected in the existing maps of the basin. The previous geological maps at a basin-scale do not recognize the main boundary and intrabasinal structures (e.g. Godoy et al., 1983a,b). In this work, we present a new themed map group of the northern sector (geological, structural, sedimentary and morphotectonic) and their implementation in a vectorial workspace, which allows a “quick&easy” analysis of fractures, segmentation structures, throws vs. distance and rifting evolution. Fractures on a map scale show a network of NE-SW, E-W to ESE-WNW, N-S and NNW-SSE fractures in the pre-rift Mesozoic rocks, while Neogene synrift sediments present a dominant N-S strike in the boundary but intrabasinal major faults with diverse orientation (NNE-SSW to NE-SW, E-W, or NW-SE). The correlation and offsets of the successive sedimentary units and seve- ral planation surfaces reveal that tectonic slip initiated at the border faults under an E-W extension, while intrabasinal ones mainly developed in a later stage

Octodon degus: A Model for the Cognitive Impairment Associated with Alzheimer's Disease

Octodon degus (O. degus) is a diurnal rodent that spontaneously develops several physiopathological conditions, analogous in many cases to those experienced by humans. In light of this, O. degus has recently been identified as a very valuable animal model for research in several medical fields, especially those concerned with neurodegenerative diseases in which risk is associated with ageing. O. degus spontaneously develops β-amyloid deposits analogous to those observed in some cases of Alzheimer’s disease (AD). Moreover, these deposits are thought to be the key feature for AD diagnosis, and one of the suggested causes of cell loss and cognitive deficit. This review aims to bring together information to support O. degus as a valuable model for the study of cerebral aging

Facies control on seismites in an alluvial–aeolian system: the Pliocene dunefield of the Teruel half-graben basin (eastern Spain)

The recognition of seismically induced soft-sediment deformation structures (SSDS) in sedimentary successions characterized by different facies, and hence by different rheology, is challenging. This is the case for high porosity and high permeability aeolian facies interbedded with muddy wet interdune deposits and alluvial conglomerates and sandstones. Several types of SSDS have been studied in two exposures of the Upper Pliocene (2.9–2.6 Ma) sediments of a fault-bounded intracontinental aeolian dune field in the Teruel Basin (Iberian Chain, eastern Spain). Among SSDS, load and fluid-escape structures, apart from several animal tracks, have been recognized. Those structures show an irregular distribution through the studied stratigraphic sections, being scarce in homogenous aeolian sands and frequent in water-related facies. A detailed study of the distribution and geometry of SSDS and their relationships with respect to the stratigraphic architecture and facies has allowed a critical discrimination of trigger mechanisms, i.e. biological or physical overloading vs. earthquakes. The seismically induced structures are concentrated into seven deformed beds, showing an uneven lateral distribution and geometry closely controlled by the hosting sedimentary facies and their rheology. These seismites resulted from liquefaction during moderate earthquakes (estimated magnitude from 5.0 to 6.8). The most probable seismogenic source was the Sierra del Pobo normal fault zone, located 2 km to the East. Results show how an appropriate recognition of sedimentary facies is crucial to understand the lateral variability of seismites in sedimentary environments characterized by sharp facies changes

On an efficient k-step iterative method for nonlinear equations

[EN] This paper is devoted to the construction and analysis of an efficient k-step iterative method for nonlinear equations. The main advantage of this method is that it does not need to evaluate any high order Frechet derivative. Moreover, all the k-step have the same matrix, in particular only one LU decomposition is required in each iteration. We study the convergence order, the efficiency and the dynamics in order to motivate the proposed family. We prove, using some recurrence relations, a semilocal convergence result in Banach spaces. Finally, a numerical application related to nonlinear conservative systems is presented. (C) 2016 Elsevier B.V. All rights reserved.This work was supported in part by the project MTM2011-28636-C02-01-{01,02} of the Spanish Ministry of Science and Innovation.Amat, S.; Bermúdez, C.; Hernández-Verón, MA.; Martínez Molada, E. (2016). On an efficient k-step iterative method for nonlinear equations. Journal of Computational and Applied Mathematics. 302:258-271. https://doi.org/10.1016/j.cam.2016.02.003S25827130

Tomato geranylgeranyl diphosphate synthase isoform 1 is involved in the stress-triggered production of diterpenes in leaves and strigolactones in roots

Carotenoids are photoprotectant pigments and precursors of hormones such as strigolactones (SL). Carotenoids are produced in plastids from geranylgeranyl diphosphate (GGPP), which is diverted to the carotenoid pathway by phytoene synthase (PSY). In tomato (Solanum lycopersicum), three genes encode plastid-targeted GGPP synthases (SlG1 to SlG3) and three genes encode PSY isoforms (PSY1 to PSY3). Here, we investigated the function of SlG1 by generating loss-of-function lines and combining their metabolic and physiological phenotyping with gene co-expression and co-immunoprecipitation analyses. Leaves and fruits of slg1 lines showed a wild-type phenotype in terms of carotenoid accumulation, photosynthesis, and development under normal growth conditions. In response to bacterial infection, however, slg1 leaves produced lower levels of defensive GGPP-derived diterpenoids. In roots, SlG1 was co-expressed with PSY3 and other genes involved in SL production, and slg1 lines grown under phosphate starvation exuded less SLs. However, slg1 plants did not display the branched shoot phenotype observed in other SL-defective mutants. At the protein level, SlG1 physically interacted with the root-specific PSY3 isoform but not with PSY1 and PSY2. Our results confirm specific roles for SlG1 in producing GGPP for defensive diterpenoids in leaves and carotenoid-derived SLs (in combination with PSY3) in roots

Chronostratigraphy and new vertebrate sites from the upper Maastrichtian of Huesca (Spain), and their relation with the K/Pg boundary

The transitional-continental facies of the Tremp Formation within the South-Pyrenean Central Unit (Spain) contain one of the best continental vertebrate records of the Upper Cretaceous in Europe. This Pyrenean area is therefore an exceptional place to study the extinction of continental vertebrates across the Cretaceous/Paleogene (K/Pg) boundary, being one of the few places in Europe that has a relatively continuous record ranging from the upper Campanian to lower Eocene. The Serraduy area, located on the northwest flank of the Tremp syncline, has seen the discovery of abundant vertebrate remains in recent years, highlights being the presence of hadrosaurid dinosaurs and eusuchian crocodylomorphs. Nevertheless, although these deposits have been provisionally assigned a Maastrichtian age, they have not previously been dated with absolute or relative methods. This paper presents a detailed stratigraphic, magnetostratigraphic and biostratigraphic study for the first time in this area, making it possible to assign most vertebrate sites from the Serraduy area a late Maastrichtian age, specifically within polarity chron C29r. These results confirm that the vertebrate sites from Serraduy are among the most modern of the Upper Cretaceous in Europe, being very close to the K/Pg boundary.Spanish Ministry of Economy and Competitiveness (grant numbers CGL2014-53548-P, CGL2015-64422-P and CGL2017-85038-P), cofinanced by the European Regional Development Fund; and by the Department of Education and Science of the Aragonese Government (grant numbers DGA groups H54 and E05), cofinanced by the European Social Fund (ESF). The paleomagnetic study was possible thanks to the complementary grants (beneficiaries of FPU, grant number CGL2010-16447/BTE: Brief Stays and Temporary Transfers, year 2015) supported by the Spanish Ministry of Culture, Education and Sports; and the Laboratory of paleomagnetism of the University of Burgos (Spain). Eduardo Puértolas Pascual is the recipient of a postdoctoral grant (SFRH/BPD/116759/2016) funded by the Fundação para a Ciência e Tecnologia (FCT-MCTES)