AtomBench: A Benchmarking Framework for Generative Crystal Reconstruction Models in Conventional Superconductors
AtomBench:传统超导体中生成晶体重建模型的基准测试框架
Charles Rhys Campbell, Aldo H. Romero, Kamal Choudhary
机构
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Department of Physics and Astronomy, West Virginia University(物理与天文学系,西弗吉尼亚大学)
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Department of Materials Science and Engineering, Whiting School of Engineering, The Johns Hopkins University(材料科学与工程系,韦廷工程学院,约翰霍普金斯大学)
Out-of-Distribution Detection in Molecular Complexes via Diffusion Models for Irregular Graphs
通过不规则图的扩散模型进行分子复合物的分布外检测
David Graber, Victor Armegioiu, Rebecca Buller, Siddhartha Mishra
机构
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Seminar for Applied Mathematics, Department of Mathematics and ETH AI Center, ETH Zurich(应用数学研讨会,数学系和ETH人工智能中心,瑞士苏黎世ETH学院)
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Institute for Computational Life Sciences, Zurich University of Applied Sciences(计算生命科学研究所,苏黎世应用科学大学)
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Department of Chemistry, Biochemistry and Pharmaceutical Sciences, University of Bern(化学、生物化学和药学系,伯尔尼大学)
机构
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National University of Defense Technology(国防科学技术大学)
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The Fifth Electronic Research Institute of MIIT(信息产业部第五电子研究所)
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University of Chinese Academy of Sciences(中国科学院大学)
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University of Science and Technology Beijing(北京科技大学)
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Hunan University(湖南大学)
Multi-Embodiment Robotic Retargeting via Guided Diffusion Model
基于引导扩散模型的多体机器人重定向
Zhefeng Cao, Ben Liu, Shunpeng Yang, Sen Li, Wei Zhang, Hua Chen
机构
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Southern University of Science and Technology(南方科技大学)
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The Hong Kong University of Science and Technology(香港科技大学)
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Zhejiang University-University of Illinois Urbana-Champaign Institute(浙江大学伊利诺伊大学厄巴纳-香槟校区联合学院)
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LimX Dynamics
Finetuning-Free Diffusion Model with Adaptive Constraint Guidance for Inorganic Crystal Structure Generation
无需微调的扩散模型结合自适应约束引导用于无机晶体结构生成
Auguste de Lambilly, Vladimir Baturin, David Portehault, Guillaume Lambard, Nataliya Sokolovska, Florence d'Alché-Buc, Jean-Claude Crivello
机构
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CNRS-Saint-Gobain-NIMS(法国国家科学研究中心-圣戈班-日本纳米科学研究所)
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Laboratory for Innovative Key Materials and Structures (LINK)(创新关键材料与结构实验室)
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Laboratory of Computational, Quantitative, and Synthetic Biology (CQSB)(计算、定量与合成生物学实验室)
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Data-driven Materials Design Group(数据驱动材料设计组)
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Center for Basic Research on Materials(材料基础研究中心)
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LTCI, Télécom Paris, Institut Polytechnique de Paris(LTCI,巴黎电信,巴黎理工学院)