Thursday, March 17, 2022
11:30AM - 11:42AM
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T16.00001: Machine-Learning-Guided Discovery of 19F MRI Agents Enabled by Automated Copolymer Synthesis
Olexandr Isayev
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Thursday, March 17, 2022
11:42AM - 11:54AM
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T16.00002: An interpretable model for polydiketoenamine recyclability
Rithwik Ghanta, Kristin Persson, Max Venetos, Alexander R Epstein, Brett Helms, Jeremy Demarteau, Hai Wang
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Thursday, March 17, 2022
11:54AM - 12:06PM
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T16.00003: Measuring mechanical properties at high-throughput using centrifugation
Muzhou Wang, Yusu Chen, Qifeng Wang, Carolyn E Mills, Johanna G Kann, Kenneth R Shull, Danielle Tullman-Ercek
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Thursday, March 17, 2022
12:06PM - 12:18PM
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T16.00004: Benchmarking Machine Learning Models for Polymer Informatics: An Example of Glass Transition Temperature
Ying Li, Lei Tao, Vikas Varshney
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Thursday, March 17, 2022
12:18PM - 12:30PM
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T16.00005: Data-efficient machine learning mimicking human intelligence in fundamental materials science
Jian Yang, Teresa Karjala, Ellen Du, Kyle Hart, Babli Kapur, YuanQiao Rao
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Thursday, March 17, 2022
12:30PM - 12:42PM
Withdrawn
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T16.00006: Using Transfer Learning to Leverage Prior Knowledge in the Prediction of Adhesive Free Energies between Polymers and Surfaces
Jiale Shi, Yamil J Colón, Jonathan K Whitmer
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Thursday, March 17, 2022
12:42PM - 12:54PM
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T16.00007: Briding the Scale-Gap: Transfer Learning for Fudamental Polymer Properties using Molecular-Dynamics Simulation Data
Umi Yamamoto, Masahiro Kitabata
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Thursday, March 17, 2022
12:54PM - 1:06PM
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T16.00008: Active Learning of Many-Body Transferable Coarse Grained Interactions in Polymers
Blake R Duschatko, Jonathan P Vandermause, Nicola Molinari, Boris Kozinsky
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Thursday, March 17, 2022
1:06PM - 1:18PM
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T16.00009: Phase Behavior Predictions of Binary Linear Polymer Solutions using Machine Learning
Jeffrey G Ethier, Rohan K Casukhela, Joshua J Latimer, Matthew D Jacobsen, Richard A Vaia
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Thursday, March 17, 2022
1:18PM - 1:54PM
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T16.00010: Unsupervised learning of sequence-specific aggregation behavior for model copolymers
Invited Speaker:
Antonia Statt
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Thursday, March 17, 2022
1:54PM - 2:06PM
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T16.00011: Molecular dynamics simulations combined with Gaussian Process regression to investigate block copolymer orientation in thin films
Suwon Bae, Marcus Noack, Kevin Yager
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Thursday, March 17, 2022
2:06PM - 2:18PM
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T16.00012: Microstructural descriptors for data-driven prediction of energetics and structures of polymer mesophases
Duyu Chen, Yao Xuan, Kris T Delaney, Hector D Ceniceros, Glenn H Fredrickson
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Thursday, March 17, 2022
2:18PM - 2:30PM
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T16.00013: Accelerating Langevin Field-Theoretic Simulation with Semantic Segmentation Model
Daeseong Yong, Jaeup Kim
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