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检索条件"机构=Department of Computational Engineering and Data Science"
1102 条 记 录,以下是711-720 订阅
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Gaussian polymer chains in a harmonic potential: The path integral approach
arXiv
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arXiv 2020年
作者: Paradezhenko, G.V. Gascoigne, C. Brilliantov, N.V. Center for Computational and Data-Intensive Science and Engineering Skolkovo Institute of Science and Technology Moscow121205 Russia Department of Mathematical Sciences University of Bath Claverton Down BathBA2 7AY United Kingdom
We study conformations of the Gaussian polymer chains in d-dimensional space in the presence of an external field with the harmonic potential. We apply a path integral approach to derive an explicit expression for the... 详细信息
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The need to implement FAIR principles in biomolecular simulations
arXiv
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arXiv 2024年
作者: Amaro, R. Åqvist, J. Bahar, I. Battistini, F. Bellaiche, A. Beltran, D. Biggin, P.C. Bonomi, M. Bowman, G.R. Bryce, R. Bussi, G. Carloni, P. Case, D. Cavalli, A. Chang, C.A. Cheatham, T.E. Cheung, M.S. Chipot, C. Chong, L.T. Choudhary, P. Cisneros, G.A. Clementi, C. Collepardo-Guevara, R. Coveney, P. Covino, R. Crawford, T.D. Dal Peraro, M. de Groot, B. Delemotte, L. De Vivo, M. Essex, J. Fraternali, F. Gao, J. Gelpí, J.L. Gervasio, F.L. Gonzalez-Nilo, F.D. Grubmüller, H. Guenza, M.G. Guzman, H.V. Harris, S. Head-Gordon, T. Hernandez, R. Hospital, A. Huang, N. Huang, X. Hummer, G. Iglesias-Fernández, J. Jensen, J.H. Jha, S. Jiao, W. Jorgensen, W.L. Kamerlin, S.C.L. Khalid, S. Laughton, C. Levitt, M. Limongelli, V. Lindahl, E. Lindorff-Larsen, K. Loverde, S. Lundborg, M. Luo, Y.L. Luque, F.J. Lynch, C.I. MacKerell, A. Magistrato, A. Marrink, S.J. Martin, H. McCammon, J.A. Merz, K. Moliner, V. Mulholland, A. Murad, S. Naganathan, A.N. Nangia, S. Noe, F. Noy, A. Oláh, J. O'Mara, M. Ondrechen, M.J. Onuchic, J.N. Onufriev, A. Osuna, S. Palermo, G. Panchenko, A.R. Pantano, S. Parish, C. Parrinello, M. Perez, A. Perez-Acle, T. Perilla, J.R. Pettitt, B.M. Pietropaolo, A. Piquemal, J.-P. Poma, A. Praprotnik, M. Ramos, M.J. Ren, P. Reuter, N. Roitberg, A. Rosta, E. Rovira, C. Roux, B. Röthlisberger, U. Sanbonmatsu, K. Schlick, T. Shaytan, A.K. Simmerling, C. Smith, J.C. Sugita, Y. Świderek, K. Taiji, M. Tao, P. Tikhonova, I.G. Tirado-Rives, J. Tuñón, I. Van Der Kamp, M.W. Van der Spoel, D. Velankar, S. Voth, G.A. Wade, R. Warshel, A. Welborn, V.V. Wetmore, S. Wong, C.F. Yang, L.-W. Zacharias, M. Orozco, M. Department of Molecular Biology University of California San DiegoCA United States Department of Cell and Molecular Biology Uppsala University Uppsala Sweden Laufer Center for Physical and Quantitative Biology Renaissance School of Medicine Stony Brook University Stony BrookNY United States Department of Biochemistry and Cell Biology Renaissance School of Medicine Stony Brook University Stony BrookNY United States Barcelona Spain European Molecular Biology Laboratory European Bioinformatics Institute Hinxton United Kingdom Structural Bioinformatics and Computational Biochemistry Department of Biochemistry University of Oxford Oxford United Kingdom Institut Pasteur Université Paris Cité CNRS UMR 3528 Computational Structural Biology Unit Paris France Department of Biochemistry and Biophysics University of Pennsylvania PhiladelphiaPA United States Division of Pharmacy and Optometry University of Manchester Manchester United Kingdom Scuola Internazionale Superiore di Studi Avanzati-SISSA Trieste Italy Computational Biomedicine Institute of Advanced Simulations IAS-5 Institute for Neuroscience and Medicine INM-9 Forschungszentrum Jülich GmbH Jülich Germany Department of Physics and Universitätsklinikum RWTH Aachen University Aachen Germany Department of Chemistry & Chemical Biology Rutgers University PiscatawayNJ United States Istituto Italiano di Tecnologia Drug Discovery and Development Bologna Italy Lausanne Switzerland Department of Chemistry University of California RiversideCA United States Department of Medicinal Chemistry College of Pharmacy University of Utah Salt Lake CityUT United States Department of Physics University of Washington SeattleWA United States Pacific Northwest National Laboratory RichlandWA United States LIA CNRS-UIUC UMR n°7019 Université de Lorraine Vandœuvre-lès-Nancy France Department of Physics University of Illinois at Urbana-Champaign UrbanaIL United States Department of Biochemistry and Molecular Biol
The communities that embraced data archiving efforts decades ago are now, in the era of data-driven biology, those gaining the most from the AI revolution. The structural biology community was a pioneer in this regard... 详细信息
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Assessing Trustworthy AI in Times of COVID-19: Deep Learning for Predicting a Multiregional Score Conveying the Degree of Lung Compromise in COVID-19 Patients
IEEE Transactions on Technology and Society
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IEEE Transactions on Technology and Society 2022年 第4期3卷 272-289页
作者: Allahabadi, Himanshi Amann, Julia Balot, Isabelle Beretta, Andrea Binkley, Charles Bozenhard, Jonas Bruneault, Frederick Brusseau, James Candemir, Sema Cappellini, Luca Alessandro Chakraborty, Subrata Cherciu, Nicoleta Cociancig, Christina Coffee, Megan Ek, Irene Espinosa-Leal, Leonardo Farina, Davide Fieux-Castagnet, Genevieve Frauenfelder, Thomas Gallucci, Alessio Giuliani, Guya Golda, Adam Van Halem, Irmhild Hildt, Elisabeth Holm, Sune Kararigas, Georgios Krier, Sebastien A. Kuhne, Ulrich Lizzi, Francesca Madai, Vince I. Markus, Aniek F. Masis, Serg Mathez, Emilie Wiinblad Mureddu, Francesco Neri, Emanuele Osika, Walter Ozols, Matiss Panigutti, Cecilia Parent, Brendan Pratesi, Francesca Moreno-Sanchez, Pedro A. Sartor, Giovanni Savardi, Mattia Signoroni, Alberto Sormunen, Hanna-Maria Spezzatti, Andy Srivastava, Adarsh Stephansen, Annette F. Theng, Lau Bee Tithi, Jesmin Jahan Tuominen, Jarno Umbrello, Steven Vaccher, Filippo Vetter, Dennis Westerlund, Magnus Wurth, Renee Zicari, Roberto V. Ey Netherlands Enterprise Intelligence Department Amsterdam1083 HP Netherlands Eth Zurich Health Ethics and Policy Lab Department of Health Sciences and Technology Zürich8092 Switzerland Center for Diplomatic and Strategic Studies Postgraduate Studies in Diplomacy and International Relations Paris75015 France Pisa56124 Italy Hackensack Meridian Health Bioethics Center EdisonNJ08820 United States University of Oxford Faculty of Philosophy OxfordOX2 6GG United Kingdom Collège André- Laurendeau Philosophie Department MontrealQCH8N 2J4 Canada Université du Québec À Montréal École des Médias MontrealQCH2L 2C4 Canada Pace University Philosophy Department New YorkNY10038 United States The Ohio State University Wexner Medical Center Department of Radiology ColumbusOH43210 United States Humanitas Research Hospital Department of Radiology Milan20089 Italy Humanitas University Department of Biomedical Sciences Milan20089 Italy University of New England Faculty of Science Agriculture Business and Law ArmidaleNSW2351 Australia University of Technology Sydney Faculty of Engineering and Information Technology SydneyNSW2007 Australia Scuola Superiore Sant'Anna European Centre of Excellence on the Regulation of Robotics and Ai Pisa56127 Italy University of Bremen Group of Computer Architecture Bremen28359 Germany New York University Grossman School of Medicine Division of Infectious Diseases and Immunology Department of Medicine New YorkNY10016 United States Digital Institute Ai Research Section Stockholm16731 Sweden Arcada University of Applied Sciences Department of Business Management and Analytics Helsinki00550 Finland University of Brescia Radiological Sciences and Public Health Department of Medical and Surgical Specialties Brescia25121 Italy Sncf Reseau Sa Ethique Groupe La Plaine93418 France Institute of Diagnostic and Interventional Radiology University Hospital Zurich Zürich8091 Switzerland Eindhoven University of Tech
This article's main contributions are twofold: 1) to demonstrate how to apply the general European Union's High-Level Expert Group's (EU HLEG) guidelines for trustworthy AI in practice for the domain of he... 详细信息
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Correction: An intelligent approach for estimating aeration efficiency in stepped cascades: optimized support vector regression models and mutual information theory
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Soft Computing 2022年 第22期26卷 12865-12865页
作者: Haji Seyed Asadollah, Seyed Babak Sharafati, Ahmad Haghbin, Masoud Motta, Davide Hosseinian Moghadam Noghani, Mohamadreza Department of Environmental Resources Engineering State University of New York College of Environmental Science and Forestry Syracuse USA Department of Civil Engineering Science and Research Branch Islamic Azad University Tehran Iran Department of Structural Mechanics and Hydraulics Engineering Andalusian Research Institute in Data Science and Computational Intelligence (DaSCI) University of Granada (UGR) Granada Spain Department of Mechanical and Construction Engineering Northumbria University Newcastle upon Tyne UK
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Interplay Between Residential Nature Exposure and Walkability and Their Association with Cardiovascular Health
JACC: Advances
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JACC: Advances 2025年 第1期4卷 101457-101457页
作者: Makram, Omar M. Nwana, Nwabunie Pan, Alan Nicolas, Juan C. Gullapelli, Rakesh Bose, Budhaditya Sabharwal, Ashutosh Chang, Jenny Javed, Zulqarnain Kash, Bita Maddock, Jay E. Nasir, Khurram Al-Kindi, Sadeer Center for Health & Nature Houston Methodist Research Institute Houston TX United States Department of Medicine Medical College of Georgia at Augusta University Augusta GA United States Center for Health Data Science and Analytics Houston Methodist Research Institute Houston TX United States Department of Electrical and Computer Engineering Rice University Houston TX United States Houston Methodist Neal Cancer Center Houston Methodist Hospital Houston TX United States Department of Environmental and Occupational Health School of Public Health Texas A&M University College Station TX United States Division of Cardiovascular Prevention and Wellness Department of Cardiology Houston Methodist DeBakey Heart and Vascular Center Houston TX United States Center for Cardiovascular Computational Health & Precision Medicine (C3-PH) Houston Methodist Hospital Houston TX United States
Background: Green space has been linked with cardiovascular (CV) health. Nature access and quality may have significant impact on CV risk factors and health. Objectives: The authors aimed to investigate the relationsh... 详细信息
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The discovery of a rotating radio transient J1918−0449 with intriguing emission properties with the five hundred meter aperture spherical radio telescope
arXiv
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arXiv 2022年
作者: Chen, J.L. Wen, Zhigang Yuan, J.P. Wang, N. Li, D. Wang, H.G. Yan, W.M. Yuen, R. Wang, P. Wang, Z. Zhu, W.W. Niu, J.R. Miao, C.C. Xue, M.Y. Gong, B.P. Department of Physics and Electronic Engineering Yuncheng University Shanxi Yuncheng044000 China Xinjiang Astronomical Observatory Chinese Academy of Sciences 150 Science-1 Street Xinjiang Urumqi830011 China Key laboratory of Radio Astronomy Chinese Academy of Sciences Nanjing210008 China Key Laboratory of Microwave Technology Urumqi Xinjiang830011 China Guizhou Provincial Key Laboratory of Radio Astronomy and Data Processing Guizhou Guiyang550001 China National Astronomical Observatories Chinese Academy of Sciences Beijing100101 China NAOC-UKZN Computational Astrophysics Centre University of KwaZulu-Natal Durban4000 South Africa School of Physics and Electronic Engineering Guangzhou University Guangzhou510006 China School of Physical Science and Technology Xinjiang University Xinjiang Urumqi830046 China Department of Physics Huazhong University of Science and Technology Wuhan430074 China
In this study, we report on a detailed single pulse analysis of the radio emission from a rotating radio transient (RRAT) J1918−0449 which is the first RRAT discovered with the five hundred meter aperture spherical ra... 详细信息
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Multivariate Analysis on Performance Gaps of Artificial Intelligence Models in Screening Mammography
arXiv
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arXiv 2023年
作者: Zhang, Linglin Brown-Mulry, Beatrice Nalla, Vineela Hwang, InChan Gichoya, Judy Wawira Gastounioti, Aimilia Banerjee, Imon Seyyed-Kalantari, Laleh Woo, MinJae Trivedi, Hari School of Data Science and Analytics Kennesaw State University 3391 Town Point Dr NW KennesawGA30144 United States Department of Information Technology Kennesaw State University 1100 South Marietta Pkwy MariettaGA30060 United States Department of Radiology and Imaging Sciences Emory University 1364 E Clifton Rd NE AtlantaGA30322 United States Computational Imaging Research Center Washington University in St. Louis School of Medicine 4525 Scott Avenue St. LouisMO63110 United States Department of Radiology Mayo Clinic Arizona 13400 E Shea Blvd ScottsdaleAZ85259 United States School of Computing and Augmented Intelligence Arizona State University 699 S Mill Ave TempeAZ85281 United States Department of Electrical Engineering and Computer Science York University 4700 Keele St TorontoONM3J 1P3 Canada
Although deep learning models for abnormality classification can perform well in screening mammography, the demographic, imaging, and clinical characteristics associated with increased risk of model failure remain unc... 详细信息
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Biases in inverse Ising estimates of near-critical behavior
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Physical Review E 2023年 第1期108卷 014109-014109页
作者: Maximilian B. Kloucek Thomas Machon Shogo Kajimura C. Patrick Royall Naoki Masuda Francesco Turci School of Physics HH Wills Physics Laboratory University of Bristol Tyndall Avenue Bristol BS8 1TL United Kingdom Bristol Centre for Functional Nanomaterials HH Wills Physics Laboratory University of Bristol Tyndall Avenue Bristol BS8 1TL United Kingdom Faculty of Information and Human Sciences Kyoto Institute of Technology Kyoto 606-8585 Japan Gulliver UMR CNRS 7083 ESPCI Paris Université PSL 75005 Paris France Department of Mathematics State University of New York at Buffalo Buffalo New York 14260-2900 USA Computational and Data-Enabled Science and Engineering Program State University of New York at Buffalo Buffalo New York 14260-5030 USA
Inverse Ising inference allows pairwise interactions of complex binary systems to be reconstructed from empirical correlations. Typical estimators used for this inference, such as pseudo-likelihood maximization (PLM),... 详细信息
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A continuum and computational framework for viscoelastodynamics: Finite deformation linear models
arXiv
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arXiv 2021年
作者: Liu, Ju Latorre, Marcos Marsden, Alison L. Department of Mechanics and Aerospace Engineering Southern University of Science and Technology Shenzhen Guangdong518055 China Guangdong-Hong Kong-Macao Joint Laboratory for Data-Driven Fluid Mechanics and Engineering Applications Southern University of Science and Technology Shenzhen Guangdong518055 China Institute for Computational and Mathematical Engineering Stanford University Clark Center E1.3 318 Campus Drive StanfordCA94305 United States Department of Biomedical Engineering Yale University New HavenCT06520 United States Department of Bioengineering Stanford University Clark Center E1.3 318 Campus Drive StanfordCA94305 United States
This work concerns the continuum basis and numerical formulation for deformable materials with viscous dissipative mechanisms. We derive a viscohyperelastic modeling framework based on fundamental thermomechanical pri... 详细信息
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Finding shortest and nearly shortest path nodes in large substantially incomplete networks
arXiv
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arXiv 2022年
作者: Kitsak, Maksim Ganin, Alexander Elmokashfi, Ahmed Cui, Hongzhu Eisenberg, Daniel A. Alderson, David L. Korkin, Dmitry Linkov, Igor Faculty of Electrical Engineering Mathematics and Computer Science Delft University of Technology Delft Netherlands Network Science Institute Northeastern University BostonMA02115 United States Department of Systems and Information Engineering University of Virginia CharlottesvilleVA22904 United States U.S. Army Engineer Research and Development Center Contractor Concord MA01742 United States Simula Metropolitan Center for Digital Engineering Oslo Norway Bioinformatics and Computational Biology Program Worcester Polytechnic Institute WorcesterMA01609 United States Institute for Genomic Medicine Columbia University Medical Center New YorkNY United States Operations Research Department Naval Postgraduate School MontereyCA93943 United States Data Science Program Worcester Polytechnic Institute WorcesterMA01609 United States Computer Science Department Worcester Polytechnic Institute WorcesterMA01609 United States U.S. Army Engineer Research and Development Center Environmental Laboratory Concord MA01742 United States
Dynamic processes on networks, be it information transfer in the Internet, contagious spreading in a social network, or neural signaling, take place along shortest or nearly shortest paths. Unfortunately, our maps of ... 详细信息
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