Results 31 to 40 of about 1,917,560 (184)
Graphics processing unit accelerated coarse-grained protein-protein docking [PDF]
, 2011 Includes abstract.Includes bibliographical references (leaves [187]-202).In this work, we describe a Graphics processing unit (GPU) implementation of the Kim-Hummer coarse-grained model for protein docking simulations, using a Replica Exchange Monte ...
Tunbridge, Dr Ian +1 more
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Rate-dependent experimental study on unsaturated coarse-grained soil controlled by matrix suction
Yantu gongcheng xuebao, 2023 To study the time-dependent deformation characteristics of high-fill subgrade in mountainous areas, the water-retention characteristics of coarse filler and a series of rate-dependent mechanical properties tests under constant suction are carried out for
YIN Fengjie 1, 2, CAI Guoqing 1, 2, SU Yanlin 1, 2, SHAN Yepeng 1, 2, LI Jian 1, 2
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Journal of Spectroscopy, 2014 The researchers cannot control the composition and structure of coarse grained soil in the indoor experiment because the granular particles of different size have the characteristics of random distribution and no sorting.
Guang-jin Wang +2 more
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Coarse-grained parallel transitive closure algorithm: Path decomposition technique
, 2003 We investigate the relation between fine-grained and coarse-grained distributed computations of a class of problems related to the generic transitive closure problem (TC for short). We choose an intricate systolic algorithm for the TC problem, by Guibas,
Gibbons, A +3 more
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A Martini-based coarse-grained soil organic matter model derived from atomistic simulations [PDF]
The significance of soil organic matter (SOM) in environmental contexts, particularly its role in pollutant adsorption, has prompted increased utilization of molecular simulations to understand microscopic interactions.
Oliver, Kuehn +2 more
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Experiment of membrane penetration on coarse grained soil
Yantu gongcheng xuebao, 2018 The membrane penetration is the most important factor influencing the measurement of volume change for triaxial consolidated-drained shear tests on coarse grained soil.
JI En-yue 1,2, ZHU Jun-gao 1,2, WANG Qing-long 3, JIANG Ming-jie 1,2
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Comparison of coarse-grained and all-atom representations by explicit energy landscape explorations [PDF]
, 2021 Computational studies of large molecular systems are often hindered by resource constraints, such as the available computational time. A common approach to reduce the computational cost is to use a coarse-grained description instead of an all-atom ...
Samuela, Pasquali +3 more
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Frontiers in Earth Science, 2022 Coarse-grained soil is widely used in the seasonal frozen soil region as subgrade filler. However, substantial frost heave has been observed in coarse filler in high-speed railway embankments.
Wanjun Huang +4 more
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Coarse-Grained Modeling Using Neural Networks Trained on Structural Data
, 2023 We propose a method of bottom-up coarse-graining, in which interactions within a coarse-grained model are determined by an artificial neural network trained on structural data obtained from multiple atomistic simulations.
Mikhail Ivanov +5 more
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Coarse-Grained Simulations of the Nanoplastic Interaction with Soil Organic Matter
The Journal of Physical Chemistry BNanoplastics (NPs) in terrestrial ecosystems represent an emerging ecological threat, yet their molecular-level interactions with soil organic matter (SOM) remain difficult to probe experimentally. Molecular simulations can bridge this gap if they capture the relevant time and length scales. Here, we employ microsecond coarse-grained molecular dynamics
Lorenz F. Dettmann +2 more
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