Progress in Advanced Characterization and Machine Learning Tools for Polymers
FOCUS · MAR-S65 · ID: MAR-S65
Presentations
-
Extracting knowledge from polymeric data via AI
Invited-In-person · Invited
–
Presenters
-
Debra Audus
- National Institute of Standards and Technology (NIST)
Authors
-
Debra Audus
- National Institute of Standards and Technology (NIST)
-
Jon Seppala
- National Institute of Standards and Tech
-
-
SEEDPoly: A Latent Embedding-Based Screening Framework for Polymer Design
Oral-In-person
–
Presenters
-
Yasemin Basdogan
- University of Rochester
Authors
-
Yasemin Basdogan
- University of Rochester
-
-
Active Learning–Driven Design of Disordered Proteins Across Coarse-Grained Models
Oral-In-person
–
Presenters
-
Zachary Lipel
- Princeton University
Authors
-
Zachary Lipel
- Princeton University
-
Wesley Oliver
- Princeton University
-
Michael Webb
- Princeton University
-
-
Theory-Informed Machine Learning of Star and Polymer-Grafted Nanoparticle Solution Phase Behavior
Oral-In-person
–
Presenters
-
Charles Li
- UES, a BlueHalo Company
Authors
-
Charles Li
- UES, a BlueHalo Company
-
Jeffrey Ethier
- Air Force Research Laboratory (AFRL)
-
Debra Audus
- National Institute of Standards and Technology (NIST)
-
-
AI Agents for Topological Polymer Simulations and Small-Angle Scattering Analysis
Oral-In-person
–
Publication: Lijie Ding and Changwoo Do. "SasAgent: Multi-Agent AI System for Small-Angle Scattering Data Analysis." arXiv preprint arXiv:2509.05363 (2025).
Lijie Ding, Jan-Michael Carrillo, and Changwoo Do. "ToPolyAgent: AI Agents for Coarse-Grained Topological Polymer Simulations" (in preparation, 2025).Presenters
-
Lijie Ding
- Oak Ridge National Laboratory
Authors
-
Lijie Ding
- Oak Ridge National Laboratory
-
Jan-Michael Carrillo
- Oak Ridge National Laboratory
-
Changwoo Do
- Oak Ridge National Lab
-
-
Automating SAXS Curve Fitting with Machine Learning: A Scalable Workflow for Nanoscale Structural Analysis
Oral-In-person · Withdrawn
–
Publication: Camara, M., Rishi, K., Beaucage, G., &
Sukumaran, S. K. (2021). A scattering
function for correlated lamellae. Polymer,
237, 124281.
https://doi.org/10.1016/j.polymer.2021.1
24281Presenters
-
Christian Dietert
- University of Texas at El Paso
Authors
-
Christian Dietert
- University of Texas at El Paso
-
Jose Banuelos
- Assitant Professor
-
Jorge Munoz
- University of Texas at El Paso
-
-
Unraveling Nonequilibrium and Cooperative Dynamics in Soft Materials through Advanced XPCS, Rheology, and AI-Driven Analysis
Invited-In-person · Invited
–
Publication: H. He, H. Liang, M. Chu, Z. Jiang, J.J. de Pablo, M.V. Tirrell, S. Narayanan, & W. Chen, Transport coefficient approach for characterizing nonequilibrium dynamics in soft matter, Proc. Natl. Acad. Sci. U.S.A. 121 (31) e2401162121, https://doi.org/10.1073/pnas.2401162121 (2024).
H. He, H. Liang, M. Chu, Z. Jiang, J.J. de Pablo, M.V. Tirrell, S. Narayanan, & W. Chen, Bridging microscopic dynamics and rheology in the yielding of charged colloidal suspensions, Proc. Natl. Acad. Sci. U.S.A. 122 (42) e2514216122, https://doi.org/10.1073/pnas.2514216122 (2025).Presenters
-
Wei Chen
- Argonne National Laboratory
Authors
-
Wei Chen
- Argonne National Laboratory
-
Hongrui He
- Argonne National Laboratory
-
Heyi Liang
- University of Florida
-
Yuan Tian
- New York University
-
Juan de Pablo
-
Matthew Tirrell
- University of Chicago
-
Suresh Narayanan
- Argonne National laboratory
-
-
Synchrotron X-Ray Mapping on Flow-Induced Crystallized Polymers
Oral-In-person
–
Publication: Macromolecules 2024, 57, 9, 4396–4409
Macromolecules 2024, 57, 16, 8012–8024
Presenters
-
Xiaoshi Zhang
- Penn State University, Erie
Authors
-
Xiaoshi Zhang
- Penn State University, Erie
-
Benson Jacob
- Pennsylvania State University
-
Jason Alexander
- Pennsylvania State University
-
Ryan Flanigan
-
Kirt Page
-
Arthur Woll
-
Ralph Colby
- Pennsylvania State University
-
Alicyn Rhoades
- Penn State University, Erie
-
-
Nanometer-Scale Chain Orientation Transitions during Fracture of High-Density Polyethylene Characterized by Nanodiffraction Imaging
Oral-In-person
–
Presenters
-
Shusuke Kanomi
- Tohoku University
Authors
-
Shusuke Kanomi
- Tohoku University
-
Hiroshi Jinnai
- Tohoku University, Japan
-
-
PRIMA: Photothermal Resonant Infrared Mechanical Analysis
Oral-In-person
–
Presenters
-
Lukas Michalek
- Stanford University
Authors
-
Lukas Michalek
- Stanford University
-
Carina Yi Jing Lim
-
-
A Small Angle Scattering Method for Quantifying Interparticle Interaction Ranges in Monoclonal Antibody Solutions
Oral-In-person
–
Publication: C.E.R. Edwards, W.C. Leite, Y. Liu. Low-Q Asymptotic Behavior of the Effective Structure Factor Yields Model-Independent Radius of Interparticle Interaction (Ri). ACS Measurement Science Au, 2025 Nov 7; XXXX(XXX): XXX-XXX.
Presenters
-
Chelsea Edwards
- National Institute of Standards and Technology (NIST)
Authors
-
Chelsea Edwards
- National Institute of Standards and Technology (NIST)
-
Yun Liu
- National Institute of Standards and Technology (NIST)
-