Machine Learning and Data in Polymer Physics I

Presentations

• Topology-Driven Completion of Chemical Data

  ORAL

  March 16, 2021, 9:00 AM – March 16, 2021, 9:12 AM

  Presenters

  • Dmitry Zubarev

    IBM Research - Almaden

  Authors

  • Dmitry Zubarev

    IBM Research - Almaden

  • Petar Ristoski

    IBM Research - Almaden

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• Chemically informed fragment choices to improve the property prediction for polymer systems

  ORAL

  March 16, 2021, 9:12 AM – March 16, 2021, 9:24 AM

  Presenters

  • Amanda Dumi

    Chemistry, University of Pittsburgh

  Authors

  • Amanda Dumi

    Chemistry, University of Pittsburgh

  • Daniel S. Lambrecht

    Chemistry & Physics, Florida Gulf Coast University

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• A Machine Learning Approach to the Design of Polymer Electrolyte Membranes

  ORAL

  March 16, 2021, 9:24 AM – March 16, 2021, 9:36 AM

  Presenters

  • Kuan-Hsuan Shen

    School of Materials Science and Engineering, Georgia Institute of Technology, Georgia Institute of Technology

  Authors

  • Kuan-Hsuan Shen

    School of Materials Science and Engineering, Georgia Institute of Technology, Georgia Institute of Technology

  • Huan Tran

    School of Materials Science and Engineering, Georgia Institute of Technology, Georgia Inst of Tech

  • Chiho Kim

    Georgia Institute of Technology, School of Materials Science and Engineering, Georgia Institute of Technology

  • Rampi Ramprasad

    Georgia Inst of Tech, Georgia Tech, Georgia Institute of Technology, School of Materials Science and Engineering, Georgia Institute of Technology

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• Identifying Accelerated Ageing Pathways for Cross-Linked Polyethylene Pipes Through Machine Learning

  ORAL

  March 16, 2021, 9:36 AM – March 16, 2021, 9:48 AM

  Presenters

  • Joseph Damico

    Univ of Guelph

  Authors

  • Joseph Damico

    Univ of Guelph

  • Melanie Hiles

    Univ of Guelph

  • Michael Grossutti

    Univ of Guelph

  • Callum Wareham

    Univ of Guelph

  • John Dutcher

    Univ of Guelph

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• Dielectric properties of polymer nanocomposite interphases from electrostatic force microscopy using machine learning

  ORAL

  March 16, 2021, 9:48 AM – March 16, 2021, 10:00 AM

  Presenters

  • Praveen Kumar Gupta

    Material Science and Engineering, Rensselaer Polytechnic Institute

  Authors

  • Praveen Kumar Gupta

    Material Science and Engineering, Rensselaer Polytechnic Institute

  • Linda Feist Schadler

    University of Vermont, College of Engineering and Mathematical Sciences, University of Vermont

  • Ravishankar Sundararaman

    Department of Materials Science and Engineering, Rensselaer Polytechnic Institute, RENSSELAER POLYTECHNIC INSTITUTE, Rensselaer Polytechnic Institute, Material Science and Engineering, Rensselaer Polytechnic Institute

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• Secondary structure of very large RNAs via high-throughput oligonucleotide-binding microarrays

  ORAL

  March 16, 2021, 10:00 AM – March 16, 2021, 10:12 AM

  Presenters

  • Ofer Kimchi

    Harvard University

  Authors

  • Ofer Kimchi

    Harvard University

  • Rees F Garmann

    Harvard University

  • Timothy Kaiwen Chiang

    Harvard University

  • Megan C Engel

    Harvard University

  • Vinothan N Manoharan

    Harvard University

  • Michael Brenner

    Harvard University, School of Engineering and Applied Sciences, Harvard University

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• Reading-out DNA translocation experiments with (un)supervised Machine Learning

  ORAL

  March 16, 2021, 10:12 AM – March 16, 2021, 10:24 AM

  Presenters

  • Ángel Díaz Carral

    University of Stuttgart

  Authors

  • Ángel Díaz Carral

    University of Stuttgart

  • Magnus Ostertag

    University of Stuttgart

  • Aleksandra Radenovic

    École Polytechnique Fédérale de Lausanne, Ecole Polytechnique Federale de Lausanne, Laboratory of Nanoscale Biology, School of Engineering, Institute of Bioengineering, EPFL

  • Maria Fyta

    University of Stuttgart

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• Understanding sequence-dependent DNA dynamics through self-associative machine learning and temperature-jump spectroscopy

  ORAL

  March 16, 2021, 10:24 AM – March 16, 2021, 10:36 AM

  Presenters

  • Mike Jones

    University of Chicago

  Authors

  • Mike Jones

    University of Chicago

  • Andrei Tokmakoff

    University of Chicago

  • Andrew Ferguson

    University of Chicago, Pritzker School of Molecular Engineering, University of Chicago

  • Brennan Ashwood

    University of Chicago

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• Machine-guided template-based polymer retrosynthesis planning

  ORAL

  March 16, 2021, 10:36 AM – March 16, 2021, 10:48 AM

  Presenters

  • Lihua Chen

    Georgia Inst of Tech, Georgia Institute of Technology

  Authors

  • Lihua Chen

    Georgia Inst of Tech, Georgia Institute of Technology

  • Jordan Lightstone

    Georgia Institute of Technology

  • Rampi Ramprasad

    Georgia Inst of Tech, Georgia Tech, Georgia Institute of Technology, School of Materials Science and Engineering, Georgia Institute of Technology

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• Active Learning of Coarse Grained Models for Free Energy Surfaces

  ORAL

  March 16, 2021, 10:48 AM – March 16, 2021, 11:00 AM

  Presenters

  • Blake Duschatko

    Harvard University

  Authors

  • Blake Duschatko

    Harvard University

  • Jonathan Vandermause

    Physics, Harvard University, Harvard University, John A. Paulson School of Engineering and Applied Sciences, Harvard University

  • Nicola Molinari

    Harvard University, John A. Paulson School of Engineering and Applied Sciences, Harvard University

  • Boris Kozinsky

    Harvard University, John A. Paulson School of Engineering and Applied Sciences, Harvard University, School of Engineering & Applied Sciences, Harvard University

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• An Autonomous Liquid-Handling Platform for ML-Driven Industrial Formulation Discovery

  ORAL

  March 16, 2021, 11:00 AM – March 16, 2021, 11:12 AM

  Presenters

  • Tyler Martin

    National Institute of Standards and Technology

  Authors

  • Peter Beaucage

    National Institute of Standards and Technology

  • Tyler Martin

    National Institute of Standards and Technology

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• Hybrid machine learning/materials science modeling for semi-crystalline polymer during film fabrication process

  ORAL

  March 16, 2021, 11:12 AM – March 16, 2021, 11:24 AM

  Presenters

  • Jian Yang

    The Dow Chemical Company

  Authors

  • Jian Yang

    The Dow Chemical Company

  • Teresa Karjala

    The Dow Chemical Company

  • Jonathan Mendenhall

    The Dow Chemical Company

  • Valeriy Ginzburg

    Dow, Inc., Dow Inc. (Retired), The Dow Chemical Company

  • Rajen Patel

    The Dow Chemical Company

  • Fawzi Hamad

    The Dow Chemical Company

  • Elva Lugo

    The Dow Chemical Company

  • Pavan Valavala

    The Dow Chemical Company

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