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2561“…Electronic band structure calculations show kagome flat-band formation with higher d-orbital contributed bonding behavior than the pristine graphene structure. …”
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2562“…In this paper, a structural health monitoring (SHM) system based on multi-scale cross-sample entropy (MSCE) is proposed for detecting damage locations in multi-bay three-dimensional structures. …”
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2563por Rogstam, Annika, Nyblom, Maria, Christensen, Signe, Sele, Celeste, Talibov, Vladimir O., Lindvall, Therese, Rasmussen, Anna Andersson, André, Ingemar, Fisher, Zoë, Knecht, Wolfgang, Kozielski, Frank“…Here, we report the biophysical characterization and 1.6 Å resolution structure of the unbound form of nsp10 from SARS-CoV-2 and compare it to the structures of its SARS homologue and the complex-bound form with nsp16 from SARS-CoV-2. …”
Publicado 2020
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2564“…[Image: see text] The SARS-CoV-2 main protease (M(pro)) is of major interest as an antiviral drug target. Structure-based virtual screening efforts, fueled by a growing list of apo and inhibitor-bound SARS-CoV/CoV-2 M(pro) crystal structures, are underway in many laboratories. …”
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2565por Nakamura, Daisuke, Tasaki, Ryohei, Kawamoto, Miki, Oshima, Hiroki, Higashihata, Mitsuhiro, Ikenoue, Hiroshi, Wakayama, Toshitaka, Sunahara, Atsushi, Higashiguchi, Takeshi“…We demonstrate a radiation hydrodynamic simulation of optical vortex pulse-ablated microcone structures on silicon (Si) substrates. Doughnut-shaped craters were formed by single pulse irradiation on the Si substrate, and a twisted cone structure with a height of 3.5 µm was created at the center of the irradiation spot by the circularly polarized optical vortex pulse. …”
Publicado 2020
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2566por Yumatov, Evgeny A.“…A fundamentally new priority method has been developed for the microsampling of endogenous substances from one brain structure for their subsequent introduction into another brain structure. …”
Publicado 2020
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2567“…Due to their flexible structure and excellent optical characteristics hollow-core photonic crystal fibers (HC-PCFs) are used in many fields, such as active optical devices, communications, and optical fiber sensing. …”
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2568“…New and compiled temperature-time constraints along the deformed and exhumed basement-cover contact allow us to (i) establish the timing of metamorphism and deformation, (ii) track long-term horizontal and vertical orogenic movements and (iii) assess the influence of temperature and structural inheritance on the kinematic evolution. We present a new shear zone map, structural cross sections and a step-wise retrodeformation. …”
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2569“…Results show that, on zip-code scale, the relative structural loss varies significantly with the percent wetland cover, the at-risk structural value, and the average wave crest height. …”
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2570“…This work presents data coming from electronic structure calculations at the Density Functional Theory level, performed in a series of organic photovoltaic materials. …”
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2571por Al Qaraghuli, Mohammed M., Kubiak-Ossowska, Karina, Ferro, Valerie A., Mulheran, Paul A.“…Here we focus on a structural analysis of hapten-antibody couples and identify potential structural movements originating from the hapten binding by comparison with unbound antibody, utilizing 40 crystal structures from the Protein Data Bank. …”
Publicado 2021
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2572por Yadav, Rohitash, Chaudhary, Jitendra Kumar, Jain, Neeraj, Chaudhary, Pankaj Kumar, Khanra, Supriya, Dhamija, Puneet, Sharma, Ambika, Kumar, Ashish, Handu, Shailendra“…In this review, we primarily focus on genomic organization, structural and non-structural protein components, and potential prospective molecular targets for development of therapeutic drugs, convalescent plasm therapy, and a myriad of potential vaccines to tackle SARS-CoV-2 infection.…”
Publicado 2021
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2573por Zhang, Kaining, Li, Xiaojiao, Wang, Zhihao, Li, Guanglin, Ma, Biyun, Chen, Huan, Li, Na, Yang, Huaiyu, Wang, Yawen, Liu, Bing“…Here, we report our systemic analysis on 22 of these structurally uncharacterized proteins, of which none has a known homologous structure due to the low sequence homology to published structures and does not belong to the category of viral structural protein. …”
Publicado 2021
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2574“…A bioinformatic analysis allowed to elucidate the functional adaptability of the proNTs family in vertebrates, identifying conserved key structural features. The combined biochemical and SAXS experiments shed lights on the structure and dynamic behavior of the human proNTs in solution, giving insights on the evolutionary conserved structural motifs, essential for the multifaceted roles of proNTs in physiological as well as in pathological contexts.…”
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2575“…BACKGROUND: Fragment libraries play a key role in fragment-assembly based protein structure prediction, where protein fragments are assembled to form a complete three-dimensional structure. …”
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2576por Barski, Michal S., Vanzo, Teresa, Zhao, Xue Zhi, Smith, Steven J., Ballandras-Colas, Allison, Cronin, Nora B., Pye, Valerie E., Hughes, Stephen H., Burke, Terrence R., Cherepanov, Peter, Maertens, Goedele N.“…Using single-particle cryo-electron microscopy we visualised XZ450 as well as the clinical HIV-1 INSTIs raltegravir and bictegravir bound to the active site of the deltaretroviral intasome. The structures reveal subtle differences in the coordination environment of the Mg(2+) ion pair involved in the interaction with the INSTIs. …”
Publicado 2021
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2577Rapid structure-function insights via hairpin-centric analysis of big RNA structure probing datasets“…The functions of RNA are often tied to its structure, hence analyzing structure is of significant interest when studying cellular processes. …”
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2578“…Recently, the importance of PAR structural heterogeneity with regards to chain length and branching came into focus. …”
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2579por Pfarr, Julia‐Katharina, Brosch, Katharina, Meller, Tina, Ringwald, Kai Gustav, Schmitt, Simon, Stein, Frederike, Meinert, Susanne, Grotegerd, Dominik, Thiel, Katharina, Lemke, Hannah, Winter, Alexandra, Waltemate, Lena, Hahn, Tim, Opel, Nils, Repple, Jonathan, Bauer, Jochen, Jansen, Andreas, Dannlowski, Udo, Krug, Axel, Kircher, Tilo, Nenadić, Igor“…Aberrant brain structural connectivity in major depressive disorder (MDD) has been repeatedly reported, yet many previous studies lack integration of different features of MDD with structural connectivity in multivariate modeling approaches. …”
Publicado 2021
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2580“…Herein, we report the first crystal structure of human ADO at a resolution of 1.78 Å with a nickel-bound metal center. …”
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