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6 Results
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Poster
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Wed 9:00 |
Spherical Channels for Modeling Atomic Interactions Larry Zitnick · Abhishek Das · Adeesh Kolluru · Janice Lan · Muhammed Shuaibi · Anuroop Sriram · Zachary Ulissi · Brandon Wood |
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Workshop
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Interdisciplinary Discovery of Nanomaterials Based on Convolutional Neural Networks Tong Xie · Yuwei Wan · Weijian Li · Qingyuan Linghu · Shaozhou Wang · Yalun Cai · Chunyu Kit · Han Liu · Clara Grazian · Bram Hoex |
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Workshop
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Fri 11:30 |
Element-Wise Formulation of Inorganic Retrosynthesis Seongmin Kim · Juhwan Noh · Geun Ho Gu · SHU-AN CHEN · Yousung Jung |
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Workshop
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Fri 8:30 |
Open MatSci ML Toolkit: A Flexible Framework for Machine Learning in Materials Science Santiago Miret · Kin Long Kelvin Lee · Carmelo Gonzales · Marcel Nassar · Krzysztof Sadowski |
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Workshop
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Fri 14:00 |
The Largest Knowledge Graph in Materials Science - Entities, Relations, and Link Prediction through Graph Representation Learning Vineeth Venugopal · Sumit Pai · Elsa Olivetti |
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Workshop
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PhAST: Physics-Aware, Scalable, and Task-specific GNNs for accelerated catalyst design ALEXANDRE DUVAL · Victor Schmidt · Alex Hernandez-Garcia · Santiago Miret · Yoshua Bengio · David Rolnick |