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检索条件"机构=Institute of Computational Mathematics and Science-Engineering Computing"
5990 条 记 录,以下是4901-4910 订阅
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Ab initio evaluation of complexation energies for cyclodextrin drug inclusion complexes
arXiv
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arXiv 2020年
作者: Oqmhula, Kenji Hongo, Kenta Maezono, Ryo Ichibha, Tom School of Materials Science JAIST 1-1 Asahidai NomiIshikawa923-1292 Japan Research Center for Advanced Computing Infrastructure JAIST 1-1 Asahidai NomiIshikawa923-1292 Japan Center for Materials Research by Information Integration Research and Services Division of Materials Data and Integrated System National Institute for Materials Science 1-2-1 Sengen Tsukuba305-0047 Japan PRESTO Japan Science and Technology Agency 4-1-8 Honcho Kawaguchi-shi Saitama322-0012 Japan Computational Engineering Applications Unit RIKEN 2-1 Hirosawa Wako Saitama351-0198 Japan School of Information Science JAIST 1-1 Asahidai NomiIshikawa923-1292 Japan
We examined the reliability of exchange-correlation functionals for molecular encapsulations combined by van der Waals forces, comparing their predictions with those of diffusion Monte Carlo method. We established tha... 详细信息
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Galactic transient sources with the Cherenkov Telescope Array Observatory
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Monthly Notices of the Royal Astronomical Society 2025年 第1期540卷 205–238页
作者: Abe, K Abe, S Abhir, J Abhishek, A Acero, F Acharyya, A Adam, R Aguasca-Cabot, A Agudo, I Aguirre-Santaella, A Alfaro, J Alfaro, R Alvarez-Crespo, N Alves Batista, R Amans, J-P Amato, E Ambrosi, G Ambrosino, F Angüner, E O Antonelli, L A Aramo, C Arcaro, C Arnesen, T T H Asano, K Ascasibar, Y Aschersleben, J Ashkar, H Augusto Stuani, L Baack, D Backes, M Balazs, C Balbo, M Baquero Larriva, A Barbosa Martins, V Barres de Almeida, U Barrio, J A Barrios-Jiménez, L Batković, I Batzofin, R Baxter, J Becerra González, J Becker Tjus, J Belmont, R Benbow, W Bernete, J Bernlöhr, K Berti, A Bertucci, B Beshley, V Bhattacharjee, P Bhattacharyya, S Bigongiari, C Bissaldi, E Blanch, O Blazek, J Bocchino, F Boisson, C Bolmont, J Bonnoli, G Bonollo, A Bordas, P Bosnjak, Z Bottacini, E Böttcher, M Bradascio, F Bronzini, E Brown, A M Brunelli, G Bulgarelli, A Burelli, I Burger-Scheidlin, C Burmistrov, L Burton, M Buscemi, M Cailleux, J Campoy-Ordaz, A Cantlay, B K Capasso, G Caproni, A Capuzzo-Dolcetta, R Caraveo, P Caroff, S Carosi, A Carosi, R Carquin, E Carrasco, M-S Cascone, E Cassol, F Castaldini, L Castrejon, N Castro-Tirado, A J Cerasole, D Ceribella, G Cerruti, M Chadwick, P M Chaty, S Chen, A W Chernyakova, M Chiavassa, A Chudoba, J Chytka, L Cicciari, G M Cifuentes, A Coimbra Araujo, C H Colapietro, M Conforti, V Contreras, J L Cortina, J Costa, A Costantini, H Cotter, G Cristofari, P Cuevas, O Curtis-Ginsberg, Z D’Aì, A D’Amico, G D’Ammando, F Dai, S Dazzi, F de Bony de Lavergne, M De Caprio, V De Cesare, G De Frondat Laadim, F de Gouveia Dal Pino, E M De Lotto, B De Lucia, M de Martino, D de Menezes, R de Naurois, M de Ona Wilhelmi, E de Souza, V del Peral, L del Valle, M V Delgado, C Dell’aiera, M Della Valle, M della Volpe, D Depaoli, D Devin, J Di Girolamo, T Di Piano, A Di Pierro, F Di Tria, R Di Venere, L Diebold, S Dignam, C Dima, R Dinesh, A Djuvsland, J Dominik, R M Dominis Prester, D Donini, A Dorner, D Dörner, J Doro, M Dubos, C Ducci, L Dwarkadas, V V Ebr, J Eckner, C Egberts, K Einecke, S Elsässer, D Emery Department of Physics Tokai University 4-1-1 Kita-Kaname Hiratsuka Kanagawa 259-1292 Japan Institute for Cosmic Ray Research University of Tokyo 5-1-5 Kashiwa-no-ha Kashiwa Chiba 277-8582 Japan ETH Zürich Institute for Particle Physics and Astrophysics Otto-Stern-Weg 5 CH-8093 Zürich Switzerland INFN and Università degli Studi di Siena Dipartimento di Scienze Fisiche della Terra e dell’Ambiente (DSFTA) Sezione di Fisica Via Roma 56 I-53100 Siena Italy Université Paris-Saclay Université Paris Cité CEA CNRS AIM F-91191 Gif-sur-Yvette Cedex France FSLAC IRL 2009 CNRS/IAC E-38205 La Laguna Tenerife Spain University of Alabama Tuscaloosa Department of Physics and Astronomy Gallalee Hall Box 870324 Tuscaloosa AL 35487-0324 USA Université Côte d’Azur Observatoire de la Côte d’Azur CNRS Laboratoire Lagrange UF 06304 Nice France Laboratoire Leprince-Ringuet CNRS/IN2P3 École Polytechnique Institut Polytechnique de Paris F-91120 Palaiseau France Departament de Física Quàntica i Astrofísica Institut de Ciències del Cosmos Universitat de Barcelona IEEC-UB Martí i Franquès 1 E-08028 Barcelona Spain Instituto de Astrofísica de Andalucía-CSIC Glorieta de la Astronomía s/n E-18008 Granada Spain Institute for Computational Cosmology and Department of Physics Durham University South Road Durham DH1 3LE UK Pontificia Universidad Católica de Chile Av. Libertador Bernardo O’Higgins 340 8331150 Santiago Chile Universidad Nacional Autónoma de México Delegación Coyoacán 04510 Ciudad de México Mexico IPARCOS-UCM Instituto de Física de Partículas y del Cosmos and EMFTEL Department Universidad Complutense de Madrid E-28040 Madrid Spain Instituto de Física Teórica UAM/CSIC and Departamento de Física Teórica Universidad Autónoma de Madrid c/ Nicolás Cabrera 13-15 Campus de Cantoblanco UAM E-28049 Madrid Spain LUTH GEPI and LERMA Observatoire de Paris Université PSL Université Paris Cité CNRS 5 place Jules Janssen F-92190 Meudon France INAF – Osservatorio
A wide variety of Galactic sources show transient emission at soft and hard X-ray energies: low- and high-mass X-ray binaries containing compact objects, isolated neutron stars exhibiting extreme variability as magnet... 详细信息
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Considering discrepancy when calibrating a mechanistic electrophysiology model
arXiv
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arXiv 2020年
作者: Lei, Chon Lok Ghosh, Sanmitra Whittaker, Dominic G. Aboelkassem, Yasser Beattie, Kylie A. Cantwell, Chris D. Delhaas, Tammo Houston, Charles Novaes, Gustavo Montes Panfilov, Alexander V. Pathmanathan, Pras Riabiz, Marina Weber dos Santos, Rodrigo Worden, Keith Mirams, Gary R. Wilkinson, Richard D. Computational Biology & Health Informatics Dept. of Computer Science University of Oxford United Kingdom MRC Biostatistics Unit University of Cambridge United Kingdom Centre for Mathematical Medicine & Biology School of Mathematical Sciences University of Nottingham United Kingdom Department of Bioengineering University of California San Diego United States Systems Modeling and Translational Biology GlaxoSmithKline R&D Stevenage United Kingdom ElectroCardioMaths Programme Centre for Cardiac Engineering Imperial College London United Kingdom CARIM School for Cardiovascular Diseases Maastricht University Netherlands Graduate Program in Computational Modeling Universidade Federal de Juiz de Fora Brazil Department of Physics and Astronomy Ghent University Belgium Laboratory of Computational Biology and Medicine Ural Federal University Ekaterinburg Russia U.S. Food and Drug Administration Center for Devices and Radiological Health Office of Science and Engineering Laboratories United States Department of Biomedical Engineering King’s College London Alan Turing Institute United Kingdom Dynamics Research Group Department of Mechanical Engineering University of Sheffield United Kingdom School of Mathematics and Statistics University of Sheffield United Kingdom
Uncertainty quantification (UQ) is a vital step in using mathematical models and simulations to take decisions. The field of cardiac simulation has begun to explore and adopt UQ methods to characterise uncertainty in ... 详细信息
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A constitutive condition for idealized isotropic Cauchy elasticity involving the logarithmic strain
arXiv
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arXiv 2024年
作者: d’Agostino, Marco Valerio Holthausen, Sebastian Bernardini, Davide Sky, Adam Ghiba, Ionel-Dumitrel Martin, Robert J. Neff, Patrizio GEOMAS INSA-Lyon Université de Lyon 20 avenue Albert Einstein Villeurbanne69621 cedex France University of Duisburg-Essen Chair for Nonlinear Analysis and Modelling Faculty of Mathematics Thea-Leymann-Straße 9 EssenD-45127 Germany Department of Structural and Geotechnical Engineering Sapienza University of Rome Rome Italy Institute of Computational Engineering and Sciences Department of Engineering Faculty of Science Technology and Medicine University of Luxembourg 6 Avenue de la Fonte L-4362 Luxembourg Alexandru Ioan Cuza University of Iaşi Department of Mathematics Blvd. Carol I no. 11 Iaşi700506 Romania Octav Mayer Institute of Mathematics of the Romanian Academy Iaşi Branch Iaşi700505 Romania Lehrstuhl für Nichtlineare Analysis und Modellierung Fakultät für Mathematik Universität Duisburg-Essen Thea-Leymann Str. 9 Essen45127 Germany University of Duisburg-Essen Head of Chair for Nonlinear Analysis and Modelling Faculty of Mathematics Thea-Leymann-Straße 9 EssenD-45127 Germany
MSC Codes 15A24, 73G05, 73G99, 74B20Following Hill and Leblond, the aim of our work is to show, for isotropic nonlinear elasticity, a relation between the corotational Zaremba-Jaumann objective derivative of the Cauch... 详细信息
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Preface
Lecture Notes in Networks and Systems
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Lecture Notes in Networks and Systems 2023年 547卷 v-vi页
作者: Thakur, Manoj Agnihotri, Samar Rajpurohit, Bharat Singh Pant, Millie Deep, Kusum Nagar, Atulya K. School of Mathematical and Statistical Sciences Indian Institute of Technology Mandi Himachal Pradesh Mandi India School of Computing and Electrical Engineering Indian Institute of Technology Mandi Himachal Pradesh Mandi India Department of Applied Science and Engineering Indian Institute of Technology Roorkee Uttarakhand Roorkee India Department of Mathematics Indian Institute of Technology Roorkee Uttarakhand Roorkee India School of Mathematics Computer Science and Engineering Liverpool Hope University Liverpool United Kingdom
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Retraction Note: Optical bio sensor based cancer cell detection using optimized machine learning model with quantum computing
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Optical and Quantum Electronics 2024年 第12期56卷 1-1页
作者: Balamurugan, G. Annadurai, C. Nelson, I. Devi, K. Nirmala Oliver, A. Sheryl Gomathi, S. Department of Computing Technologies SRM Institute of Science and Technology Kattankulathur India Department of ECE Sri Sivasubramaniya Nadar College of Engineering Kalavakkam Chennai India Department of Electrical and Electronics Saveetha School of Engineering SIMATS Chennai India Department of CSE Kongu Engineering College Perundurai Erode India Department of Computational Intelligence SRM Institute of Science and Technology Kattankulathur India
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Sp(2N) Yang-Mills theories on the lattice: scale setting and topology
arXiv
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arXiv 2022年
作者: Bennett, Ed Hong, Deog Ki Lee, Jong-Wan Lin, C.-J. David Lucini, Biagio Piai, Maurizio Vadacchino, Davide Swansea Academy of Advanced Computing Swansea University Fabian Way Swansea WalesSA1 8EN United Kingdom Department of Physics Pusan National University Busan46241 Korea Republic of Institute for Extreme Physics Pusan National University Busan46241 Korea Republic of Institute of Physics National Yang Ming Chiao Tung University 1001 Ta-Hsueh Road Hsinchu30010 Taiwan Center for High Energy Physics Chung-Yuan Christian University Chung-Li32023 Taiwan Centre for Theoretical and Computational Physics National Yang Ming Chiao Tung University 1001 Ta-Hsueh Road Hsinchu30010 Taiwan Physics Division National Centre for Theoretical Sciences Taipei10617 Taiwan Department of Mathematics Faculty of Science and Engineering Swansea University Fabian Way Swansea WalesSA1 8EN United Kingdom Department of Physics Faculty of Science and Engineering Swansea University Singleton Park Swansea WalesSA2 8PP United Kingdom School of Mathematics Hamilton Mathematics Institute Trinity College Dublin 2 Ireland Centre for Mathematical Sciences University of Plymouth PlymouthPL4 8AA United Kingdom
We study Yang-Mills lattice theories with Sp(Nc) gauge group, with Nc = 2N, for N = 1, ···, 4. We show that if we divide the renormalised couplings appearing in the Wilson flow by the quadratic Casimir ... 详细信息
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JARVIS-Leaderboard: A Large Scale Benchmark of Materials Design Methods
arXiv
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arXiv 2023年
作者: Choudhary, Kamal Wines, Daniel Garrity, Kevin F. Williams, Maureen Tavazza, Francesca Li, Kangming Hattrick-Simpers, Jason Gupta, Vishu Romero, Aldo H. Krogel, Jaron T. Saritas, Kayahan Fuhr, Addis Ganesh, Panchapakesan Kent, Paul R.C. Yan, Keqiang Lin, Yuchao Ji, Shuiwang Blaiszik, Ben Reiser, Patrick Friederich, Pascal Agrawal, Ankit Tiwary, Pratyush Beyerle, Eric Minch, Peter Rhone, Trevor David Takeuchi, Ichiro Wexler, Robert B. Mannodi-Kanakkithodi, Arun Ertekin, Elif Mishra, Avanish Mathew, Nithin Wood, Mitchell Rohskopf, Andrew Dale Wang, Shih-Han Achenie, Luke E.K. Xin, Hongliang Biacchi, Adam J. Material Measurement Laboratory National Institute of Standards and Technology MD20899 United States Department of Materials Science and Engineering University of Toronto 27 King’s College Cir TorontoON Canada Department of Electrical and Computer Engineering Northwestern University EvanstonIL60208 United States Lewis-Sigler Institute for Integrative Genomics Princeton University PrincetonNJ08544 United States Ludwig Institute for Cancer Research Princeton University PrincetonNJ08544 United States Department of Physics and Astronomy West Virginia University MorgantownWV26506 United States Materials Science and Technology Division Oak Ridge National Laboratory Oak RidgeTN37831 United States Center for Nanophase Materials Science Oak Ridge National Laboratory Oak RidgeTN37831 United States Computational Sciences and Engineering Division Oak Ridge National Laboratory Oak RidgeTN37831 United States Department of Computer Science and Engineering Texas A&M University College StationTX77843 United States Globus University of Chicago IL60637 United States Data Science Learning Division National Lab ArgonneIL60439 United States Institute of Nanotechnology Karlsruhe Institute of Technology Kaiserstraße 12 Karlsruhe76131 Germany Institute of Theoretical Informatics Karlsruhe Institute of Technology Kaiserstraße 12 Karlsruhe76131 Germany Department of Chemistry and Biochemistry Institute for Physical Science and Technology University of Maryland College ParkMD20742 United States Department of Physics Applied Physics and Astronomy Rensselaer Polytechnic Institute TroyNY12180 United States Department of Materials Science and Engineering University of Maryland College ParkMD20742 United States Department of Chemistry Institute of Materials Science and Engineering Washington University in St. Louis St. LouisMO63130 United States School of Materials Engineering Purdue University West LafayetteIN47907 United States Department of Mechan
Lack of rigorous reproducibility and validation are significant hurdles for scientific development across many fields. Materials science, in particular, encompasses a variety of experimental and theoretical approaches... 详细信息
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DeePMD-kit v2: A software package for Deep Potential models
arXiv
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arXiv 2023年
作者: Zeng, Jinzhe Zhang, Duo Lu, Denghui Mo, Pinghui Li, Zeyu Chen, Yixiao Rynik, Marián Huang, Li'ang Li, Ziyao Shi, Shaochen Wang, Yingze Ye, Haotian Tuo, Ping Yang, Jiabin Ding, Ye Li, Yifan Tisi, Davide Zeng, Qiyu Bao, Han Xia, Yu Huang, Jiameng Muraoka, Koki Wang, Yibo Chang, Junhan Yuan, Fengbo Bore, Sigbjørn Løland Cai, Chun Lin, Yinnian Wang, Bo Xu, Jiayan Zhu, Jia-Xin Luo, Chenxing Zhang, Yuzhi Goodall, Rhys E.A. Liang, Wenshuo Singh, Anurag Kumar Yao, Sikai Zhang, Jingchao Wentzcovitch, Renata Han, Jiequn Liu, Jie Jia, Weile York, Darrin M. Weinan, E. Car, Roberto Zhang, Linfeng Wang, Han Laboratory for Biomolecular Simulation Research Institute for Quantitative Biomedicine Department of Chemistry and Chemical Biology Rutgers University PiscatawayNJ08854 United States AI for Science Institute Beijing100080 China DP Technology Beijing100080 China Academy for Advanced Interdisciplinary Studies Peking University Beijing100871 China HEDPS CAPT College of Engineering Peking University Beijing100871 China College of Electrical and Information Engineering Hunan University Changsha China Yuanpei College Peking University Beijing100871 China Program in Applied and Computational Mathematics Princeton University PrincetonNJ08540 United States Department of Experimental Physics Comenius University Mlynská Dolina F2 Bratislava842 48 Slovakia Center for Quantum Information Institute for Interdisciplinary Information Sciences Tsinghua University Beijing100084 China Center for Data Science Peking University Beijing100871 China ByteDance Research Zhonghang Plaza No. 43 North 3rd Ring West Road Haidian District Beijing China College of Chemistry and Molecular Engineering Peking University Beijing100871 China Baidu Inc. Beijing China Key Laboratory of Structural Biology of Zhejiang Province School of Life Sciences Westlake University Zhejiang Hangzhou China Westlake AI Therapeutics Lab Westlake Laboratory of Life Sciences and Biomedicine Zhejiang Hangzhou China Department of Chemistry Princeton University PrincetonNJ08544 United States SISSA Scuola Internazionale Superiore di Studi Avanzati Trieste34136 Italy Laboratory of Computational Science and Modeling Institute of Materials École Polytechnique Fédérale de Lausanne Lausanne1015 Switzerland Department of Physics National University of Defense Technology Hunan Changsha410073 China State Key Lab of Processors Institute of Computing Technology Chinese Academy of Sciences Beijing China University of Chinese Academy of Sciences Beijing China School of Electronics Engineerin
DeePMD-kit is a powerful open-source software package that facilitates molecular dynamics simulations using machine learning potentials (MLP) known as Deep Potential (DP) models. This package, which was released in 20... 详细信息
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THU676 Real-time Assessment Of The Beneficial Role Of Computer-Aided Diagnosis In The Diagnosis Of Thyroid Nodules On Ultrasound
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Journal of the Endocrine Society 2023年 第SUPPLEMENT_1期7卷
作者: Youngsook Kim Sungjae Shin Eunjung Lee Daham Kim Jin Young Kwak Department of Internal Medicine Institute of Endocrine Research Yonsei University College of Medicine Seoul Korea Republic of Department of Internal Medicine National Health Insurance Service Ilsan Hospital Gyeonggi-do Korea Republic of School of Mathematics and Computing (Computational Science and Engineering) Yonsei University Seoul Korea Republic of Department of Radiology Severance Hospital Research Institute of Radiological Science Seoul Korea Republic of
Disclosure: Y. Kim:None.S. Shin:None.E. Lee:None.D. Kim:None.J. Kwak:None.
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