| CARVIEW |
Machine Learning and the Physical Sciences
Workshop at the 38th conference on Neural Information Processing Systems (NeurIPS)
December 15, 2024
About
The Machine Learning and the Physical Sciences workshop aims to provide an informal, inclusive, and leading-edge venue for discussing research and challenges at the intersection of machine learning (ML) and the physical sciences (PS). This includes the applications of ML to problems in the physical sciences (ML for PS) as well as developments in ML motivated by physical insights (PS for ML).
Physical sciences are defined inclusively, including but not limited to physics, astronomy, cosmology, chemistry, biophysics, materials science, and Earth science.
Recent years have highlighted unique opportunities as well as challenges in incorporating ML workflows as part of the scientific process in many physical sciences. For example, fields focused on fundamental physics discovery, such as particle physics and cosmology, often have stringent requirements for exactness, robustness, and latency that go beyond those typically encountered in other scientific domains and industry applications. Data preservation and workflow reproducibility are other central challenges that need to be addressed in the era of large experiments, collaborations, and datasets. In these fields and others, simulations play a central role in connecting theoretical models to observations. The ubiquity and increasing complexity of simulators in PS has spurred methodological advances in ML, e.g. in simulation-based inference and differentiable programming, that are finding applications far beyond PS, showcasing the bidirectional nature of the PS-ML intersection.
The breadth of work at the intersection of ML and physical sciences is answering many important questions for both fields while opening up new ones that can only be addressed by a joint effort of both communities. By bringing together ML researchers and physical scientists who apply and study ML, we expect to strengthen the much needed interdisciplinary dialogue, introduce exciting new open problems to the broader community, and stimulate the production of new approaches to solving challenging open problems in the sciences. Invited talks from leading individuals in both communities will cover the state-of-the-art techniques and set the stage for this workshop, which will also include contributed talks selected from submissions.
The invited talks program will showcase unique features of the physical sciences that highlight current challenges and bidirectional opportunities in ML and PS. This includes the central role of simulators in the scientific process, the need for rigorous uncertainty quantification, and the development of hardware-software co-design solutions for real-time inference.
A part of the workshop program will be dedicated to the focus area discussing the role of data-driven vs inductive bias-driven methods in machine learning and the physical sciences, centering the emerging role of foundation models and their complementarity with approaches leveraging physical inductive biases. This will feature an overview talk, followed by a moderated panel discussion.
NeurIPS 2024
The Machine Learning and the Physical
Sciences 2024 workshop will be held on December 15, 2024 at the Vancouver Convention
Center
in Vancouver, BC, Canada as a part of the 38th annual
conference on
Neural Information Processing Systems (NeurIPS). The workshop is planned to take
place in a hybrid format inclusive of virtual participation.
Schedule
All times are local Vancouver time. See also the official NeurIPS workshop schedule.
| 08:15 - 08:30 | Opening remarks |
| 08:30 - 09:00 |
Invited talk: Data-driven vs inductive bias-driven methods in machine learning and the physical sciences Lukas Heinrich |
| 09:00 - 10:00 |
Panel: Data-driven vs inductive bias-driven methods in machine learning and
the physical sciences Anima Anandkumar, Naoya Takeishi, Johannes Brandstetter |
| 10:00 - 10:30 | Coffee break ☕️ |
| 10:30 - 11:00 |
Invited talk: Pushing the limits of real-time ML: Nanosecond inference for Physics Discovery at the LHC Thea Klaeboe Aarrestad |
| 11:00 - 11:05 | Paper prizes announcement |
| 11:05 - 12:15 |
Poster session 1 Papers 1-135 |
| 12:15 - 13:15 | Lunch break |
| 13:15 - 13:30 |
Contributed talk: Joint cosmological parameter inference and initial condition
reconstruction with Stochastic Interpolants Carolina Cuesta |
| 13:30 - 14:00 |
Invited talk: Large language models & quantum many-body physics: a case study Yasaman Bahri |
| 14:00 - 14:30 |
Invited talk: Valid scientific inference with neural density estimators and generative models Ann Lee |
| 14:30 - 14:45 |
Contributed talk: Flow Annealed Importance Sampling Bootstrap meets Differentiable Particle Physics Annalena Kofler |
| 14:45 - 15:00 |
Contributed talk: Robust Emulator for Compressible Navier-Stokes using Equivariant
Geometric Convolutions Wilson G. Gregory |
| 15:00 - 15:30 | Coffee break ☕️ |
| 15:30 - 15:45 |
Contributed talk: The State of Julia for Scientific Machine Learning Edward Berman |
| 15:45 - 16:15 |
Invited talk: Data-Driven High-Dimensional Inverse Problems: A Journey Through Strong Gravitational Lensing Data Analysis Laurence Perreault-Levasseur |
| 16:15 - 17:25 |
Poster session 2 Papers 135+ |
| 17:25 - 17:30 | Closing remarks |
Speakers
-
Thea AarrestadETH Zurich
-
Yasaman BahriGoogle DeepMind
-
Lukas HeinrichTechnical University of Munich
-
Ann LeeCarnegie Mellon University
-
Laurence Perreault-Levasseur Université de Montréal / Mila
Panelists
Topic: Data-driven vs inductive bias-driven methods in machine learning and the physical sciences.
-
Anima AnandkumarCaltech
-
Johannes BrandstetterJKU Linz / NXAI
-
Naoya TakeishiUniversity of Tokyo / RIKEN
Papers
Accepted papers are listed below.
| 2 | Neural Infalling Clouds: Increasing the Efficacy of Subgrid Models and
Scientific Equation Discovery using Neural ODEs and Symbolic
Regression
[paper]
[poster]
Brent Tan |
| 4 | Meta-Learned Bayesian Optimization for Energy Yield in Inertial
Confinement Fusion
[paper]
[poster]
[video] Vineet Gundecha, Ricardo Luna Gutierrez, Sahand Ghorbanpour, Desik Rengarajan, Rahman Ejaz, Varchas Gopalaswamy, Riccardo Betti, Soumyendu Sarkar |
| 5 | Uncertainty-Penalized Bayesian Information Criterion for Parametric
Partial Differential Equation Discovery
[paper]
[poster]
[video] Pongpisit Thanasutives, Ken-ichi Fukui |
| 6 | Multimodal multi-output ordinal regression for discovering
gravitationally-lensed transients
[paper]
[poster]
Nicolò Oreste Pinciroli Vago, Piero Fraternali |
| 8 | LLM Enhanced Bayesian Optimization for Scientific Applications like
Fusion
[paper]
[poster]
[video] Sahand Ghorbanpour, Ricardo Luna Gutierrez, Vineet Gundecha, Desik Rengarajan, Ashwin Ramesh Babu, Soumyendu Sarkar |
| 9 | Normalising Flow for Joint Cosmological Analysis
[paper]
[poster]
Arrykrishna Mootoovaloo, David Alonso, Jaime Ruiz-Zapatero, Carlos Garcia-Garcia |
| 10 | Emulation and Assessment of Gradient-Based Samplers in
Cosmology
[paper]
[poster]
Arrykrishna Mootoovaloo, David Alonso, Jaime Ruiz-Zapatero, Carlos Garcia-Garcia |
| 11 | Two-Stage Coefficient Estimation in Symbolic Regression for Scientific
Discovery
[paper]
[poster]
Masahiro Negishi, Yoshitomo Matsubara, Naoya Chiba, Ryo Igarashi, Yoshitaka Ushiku |
| 13 | Path-minimizing Latent ODEs as Inference Models
[paper]
[poster]
Matt L. Sampson, Peter Melchior |
| 14 | Climate PAL: Climate Analysis through Conversational AI
[paper]
[poster]
Sonia Cromp, Behrad Rabiei, Maxwell T. Elling, Alexander J. Herron, Michael Hendrickson |
| 16 | Physics-guided Optimization of Photonic Structures using Denoising
Diffusion Probabilistic Models
[paper]
[poster]
Dongjin Seo, Soobin Um, Sangbin Lee, Jong Chul Ye, Haejun Chung |
| 17 | Galaxy Formation and Evolution via Phase-temporal Clustering with
FuzzyCat $\circ$ AstroLink
[paper]
[poster]
William H. Oliver, Tobias Buck |
| 18 | Constrained Synthesis with Projected Diffusion Models
[paper]
[poster]
Jacob K Christopher, Stephen Baek, Ferdinando Fioretto |
| 19 | ClariPhy: Physics-Informed Image Deblurring with Transformers for
Hydrodynamic Instability Analysis
[paper]
[poster]
[video] Shai Stamler-Grossman, Nadav Schneider, Gershon Hanoch, Gal Oren Reproducibility badge 🏅; Datasets & benchmarks track |
| 20 | Evidential deep learning for probabilistic modelling of extreme storm
events
[paper]
[poster]
Ayush Khot, Xihaier Luo, Ai Kagawa, Shinjae Yoo |
| 21 | Learning Fluid-Directed Rigid Body Control
[paper]
[poster]
Karlis Freivalds, Oskars Teikmanis, Laura Leja, Saltanovs Rodions, Ralfs Āboliņš |
| 22 | Galaxy Morphology Classification with Counterfactual
Explanation
[paper]
[poster]
Zhuo Cao, Lena Krieger, Hanno Scharr, Ira Assent |
| 23 | Dyson Brownian motion and random matrix dynamics of weight matrices
during learning
[paper]
[poster]
Gert Aarts, Ouraman Hajizadeh, Biagio Lucini, Chanju Park |
| 24 | Towards Using Large Language Models and Deep Reinforcement Learning for
Inertial Fusion Energy
[paper]
[poster]
Vadim Elisseev, Massimiliano Esposito, James C Sexton Perspectives track |
| 26 | Improving Flow Matching for Simulation-Based Inference
[paper]
[poster]
Janis Fluri, Thomas Hofmann |
| 28 | Automated discovery of large-scale, noise-robust experimental designs in
super-resolution microscopy
[paper]
[poster]
Carla Rodríguez, Sören Arlt, Leonhard Möckl, Mario Krenn |
| 30 | Neural Network Simulation of Time-variant Waves on Arbitrary Grids with
Applications in Active Sonar
[paper]
[poster]
[video] Yash Ranjith |
| 32 | Efficient Generation of Molecular Clusters with Dual-Scale Equivariant
Flow Matching
[paper]
[poster]
Akshay Subramanian, Shuhui Qu, Cheol Woo Park, Sulin Liu, Janghwan Lee, Rafael Gomez-Bombarelli |
| 34 | Scalable physics-guided data-driven component model reduction for steady
Navier-Stokes flow
[paper]
[poster]
Seung Whan Chung, Youngsoo Choi, Pratanu Roy, Thomas Roy, Tiras Lin, Du Nguyen, Christopher Hahn, Eric Duoss, Sarah Baker |
| 37 | From particle clouds to tokens: building foundation models for particle
physics
[paper]
[poster]
Joschka Birk, Anna Hallin, Gregor Kasieczka |
| 39 | Domain Adaptation of Drag Reduction Policy to Partial
Measurements
[paper]
[poster]
Anton Plaksin, Georgios Rigas |
| 40 | Reconstructing dissipative dynamical systems from spatially and
temporally sparse sensors
[paper]
[poster]
Alex Guo, Galen T. Craven, Javier E. Santos, Charles D. Young |
| 41 | BNEM: A Boltzmann Sampler Based on Bootstrapped Noised Energy
Matching
[paper]
[poster]
RuiKang OuYang, Bo Qiang, José Miguel Hernández-Lobato |
| 42 | The State of Julia for Scientific Machine Learning
[paper]
[poster]
Edward Berman, Jacob Ginesin Perspectives track |
| 43 | AP-SVM: Unsupervised Data Cleaning for the LEGEND Experiment
[paper]
[poster]
Reproducibility badge 🏅 Esteban León, Julieta Gruszko, Aobo Li, Brady Bos, M.A. Bahena Schott, John Wilkerson, Reyco Henning, Matthew Busch, Eric L. Martin, Guadalupe Duran, J.R. Chapman |
| 44 | ChemLit-QA: A human evaluated dataset for chemistry RAG tasks
[paper]
[poster]
Geemi Wellawatte, Philippe Schwaller, Huixuan Guo, Marta Brucka, Anna Borisova, Matthew Hart, Magdalena Lederbauer Datasets & benchmarks track |
| 45 | GraphNeT 2.0 - A Deep Learning Library for Neutrino Telescopes
[paper]
[poster]
Rasmus F. Ørsøe, Aske Rosted |
| 46 | Towards Agentic AI on Particle Accelerators
[paper]
[poster]
Antonin Sulc, Thorsten Hellert, Raimund Kammering, Hayden R. Hoschouer, Jason M. St. John Perspectives track |
| 47 | A Poisson-process AutoDecoder for Astrophysical, Time-variable, X-ray
Sources
[paper]
[poster]
Yanke Song, V Ashley Villar, Juan Rafael Martínez-Galarza |
| 48 | A method for identifying causality in the response of nonlinear
dynamical systems
[paper]
[poster]
Joseph Massingham, Ole Mattis Nielsen, T Butlin |
| 50 | Meta-Designing Quantum Experiments with Language Models
[paper]
[poster]
Sören Arlt, Haonan Duan, Felix Li, Sang Michael Xie, Yuhuai Wu, Mario Krenn |
| 53 | A machine learning approach to duality in statistical physics
[paper]
[poster]
Prateek Gupta, Andrea E. V. Ferrari, Nabil Iqbal |
| 54 | Synax: A Differentiable and GPU-accelerated Synchrotron Simulation
Package
[paper]
[poster]
Kangning Diao, Zack Li, Richard D.P. Grumitt, Yi Mao |
| 56 | Explicit and data-Efficient Encoding via Gradient Flow
[paper]
[poster]
Kyriakos Flouris, Anna Volokitin, Gustav Bredell, Ender Konukoglu |
| 58 | Neural network prediction of strong lensing systems with domain
adaptation and uncertainty quantification
[paper]
[poster]
Shrihan Agarwal, Aleksandra Ciprijanovic, Brian Nord |
| 59 | Generation and Human-Expert Evaluation of Interesting Research Ideas using Knowledge Graphs and Large Language Models
[paper]
[poster]
Reproducibility badge 🏅 Xuemei Gu, Mario Krenn |
| 60 | Physics-informed Discovery of State Variables in Second-Order and
Hamiltonian Systems
[paper]
[poster]
Félix Chavelli, Zi-Yu Khoo, Dawen Wu, Jonathan Sze Choong Low, Stéphane Bressan |
| 61 | Neural 3D Reconstruction of 21-cm Tomographic Data
[paper]
[poster]
Nashwan Sabti, Ram Purandhar Reddy Sudha, Julian B. Muñoz, Siddharth Mishra-Sharma, Taewook Youn |
| 62 | Machine learned reconstruction of tsunami waves from sparse
observations
[paper]
[poster]
Edward McDugald, Darren Engwirda, Arvind Mohan, Agnese Marcato, Javier E. Santos |
| 65 | Toward Model-Agnostic Detection of New Physics Using Data-Driven Signal
Regions
[paper]
[poster]
Soheun Yi, John Alison, Mikael Kuusela |
| 66 | Learning Pore-scale Multi-phase Flow from Experimental Data with Graph
Neural Network
[paper]
[poster]
Yuxuan Gu, Catherine Spurin, Gege Wen |
| 67 | Harnessing Loss Decomposition for Long-Horizon Wave Predictions via Deep
Neural Networks
[paper]
[poster]
Indu Kant Deo, Rajeev K. Jaiman |
| 68 | Scalable nonlinear manifold reduced order model for dynamical
systems
[paper]
[poster]
Ivan Zanardi, Alejandro N. Diaz, Seung Whan Chung, Marco Panesi, Youngsoo Choi |
| 69 | CODES: Benchmarking Coupled ODE Surrogates
[paper]
[poster]Reproducibility badge 🏅
Robin Janssen, Immanuel Sulzer, Tobias Buck Datasets & benchmarks track |
| 70 | Transfer Learning in Materials Informatics: structure-property
relationships through minimal but highly informative multimodal
input
[paper]
[poster]
[video] Dario Massa, Grzegorz Kaszuba, Stefanos Papanikolaou, Piotr Sankowski |
| 71 | Higher-order cumulants in diffusion models
[paper]
[poster]
Gert Aarts, Diaa Eddin Habibi, Lingxiao Wang, Kai Zhou |
| 72 | Learning functional forms of fragmentation functions for hadron
production using symbolic regression
[paper]
[poster]
Nour Makke, Sanjay Chawla |
| 74 | Training Hamiltonian neural networks without backpropagation
[paper]
[poster]
[video] Atamert Rahma, Chinmay Datar, Felix Dietrich |
| 75 | Reconstructing micro-magnetic vector fields based on topological charge
distributions via generative neural network systems
[paper]
[poster]
Kyra H. M. Klos, Jan Disselhoff, Karin Everschor-Sitte, Friederike Schmid |
| 76 | PICL: Learning to Incorporate Physical Information When Only
Coarse-Grained Data is Available
[paper]
[poster]
Haodong Feng, Yue Wang, Dixia Fan |
| 77 | Fast GPU-Powered and Auto-Differentiable Forward Modeling of IFU Data
Cubes
[paper]
[poster]
Ufuk Çakır, Anna Lena Schaible, Tobias Buck |
| 78 | LensPINN: Physics Informed Neural Network for Learning Dark Matter
Morphology in Lensing
[paper]
[poster]
Ashutosh Ojha, Sergei Gleyzer, Michael W. Toomey, Pranath Reddy |
| 79 | Deep Learning Based Superconductivity Prediction and Experimental
Tests
[paper]
[poster]
Daniel Kaplan, Adam Zheng, Joanna Blawat, Rongying Jin, Viktor Oudovenko, Gabriel Kotliar, Weiwei Xie, Anirvan M. Sengupta |
| 81 | Diffusion models for lattice gauge field simulations
[paper]
[poster]
Qianteng Zhu, Gert Aarts, Wei Wang, Kai Zhou, Lingxiao Wang |
| 83 | First High-Resolution Galaxy Simulations Accelerated by a 3D Surrogate
Model for Supernovae
[paper]
[poster]
Keiya Hirashima, Kana Moriwaki, Michiko S. Fujii, Yutaka Hirai, Takayuki R. Saitoh, Junichiro Makino, Ulrich Philipp Steinwandel, Shirley Ho |
| 84 | Inferring Stability Properties of Chaotic Systems on Autoencoders’
Latent Spaces
[paper]
[poster]
Elise Özalp, Luca Magri |
| 86 | PhysBERT: A Text Embedding Model for Physics Scientific
Literature
[paper]
[poster]
Thorsten Hellert, Andrea Pollastro, João Montenegro |
| 88 | Cosmological super-resolution of the 21-cm signal
[paper]
[poster]
Simon Pochinda, Jiten Dhandha, Anastasia Fialkov, Eloy de Lera Acedo |
| 89 | DiffLense: A Conditional Diffusion Model for Super-Resolution of
Gravitational Lensing Data
[paper]
[poster]
Pranath Reddy, Michael W. Toomey, Hanna Parul, Sergei Gleyzer |
| 90 | Accelerated Bayesian parameter estimation and model selection for
gravitational waves with normalizing flows
[paper]
[poster]
Alicja Polanska, Thibeau Wouters, Peter Tsun Ho Pang, Kaze W. K. Wong, Jason McEwen |
| 91 | Gaussian Processes for Probabilistic Estimates of Earthquake Ground
Shaking: A 1-D Proof-of-Concept
[paper]
[poster]
Sam A. Scivier, Tarje Nissen-Meyer, Paula Koelemeijer, Atilim Gunes Baydin |
| 93 | Efficient and Unbiased Sampling of Boltzmann Distributions via
Consistency Models
[paper]
[poster]
Fengzhe Zhang, Jiajun He, Laurence Illing Midgley, Javier Antoran, José Miguel Hernández-Lobato |
| 94 | PCN: a deep learning approach to jet tagging utilizing novel graph
construction methods and Chebyshev graph convolutions
[paper]
[poster]
Mihir Relan, Yash Semlani, Krithik Ramesh |
| 96 | Embedding Theoretical Baselines For Satellite Force Estimations
[paper]
[poster]
Benjamin Y. J. Wong, Sai Sudha Ramesh, Khoo Boo Cheong |
| 97 | DYffCast: Regional Precipitation Nowcasting Using IMERG Satellite Data.
A case study over South America
[paper]
[poster]
Daniel Seal, Rossella Arcucci, Salva Rühling Cachay, César Quilodrán-Casas |
| 101 | D3PU: Denoising Diffusion Detector Probabilistic Unfolding in
High-Energy Physics
[paper]
[poster]
Camila Pazos, Shuchin Aeron, Pierre-Hugues Beauchemin, Vincent Croft, Martin Klassen, Taritree Wongjirad |
| 102 | CASBI – Chemical Abundance Simulation-Based Inference for Galactic
Archeology
[paper]
[poster]
Giuseppe Viterbo, Tobias Buck |
| 103 | Neural rendering enables dynamic tomography
[paper]
[poster]
Ivan Grega, William F Whitney, Vikram Deshpande |
| 104 | Evaluating Sparse Galaxy Simulations via Out-of-Distribution Detection
and Amortized Bayesian Model Comparison
[paper]
[poster]
Lingyi Zhou, Stefan T. Radev, William H. Oliver, Aura Obreja, Zehao Jin, Tobias Buck |
| 107 | Domain adaptation in application to gravitational lens finding
[paper]
[poster]
Hanna Parul, Michael W. Toomey, Pranath Reddy, Sergei Gleyzer |
| 108 | TELD: Trajectory-Level Langevin Dynamics for Versatile Constrained
Sampling
[paper]
[poster]
Magnus Petersen, Gemma Roig, Roberto Covino |
| 109 | Dynamic Curriculum Regularization for Enhanced Training of
Physics-Informed Neural Networks
[paper]
[poster]
Callum Duffy, Gergana V. Velikova |
| 110 | Semi-supervised Super-resolution for Gravitational Lenses with Estimated
Degradation Model
[paper]
[poster]
Peimeng Guan, Michael W. Toomey, Sergei Gleyzer |
| 111 | Using different sources of ground truths and transfer learning to
improve the generalization of photometric redshift estimation
[paper]
[poster]
Jonathan Soriano, Srinath Saikrishnan, Vikram Seenivasan, Bernie Boscoe, Jack Singal, Tuan Do |
| 112 | Can KANs (re)discover predictive models for Direct-Drive Laser
Fusion?
[paper]
[poster]
Rahman Ejaz, Varchas Gopalaswamy, Aarne Lees, Riccardo Betti, Christopher Kanan |
| 113 | Uncertainty Quantification for Martian Surface Spectral Analysis using
Bayesian Deep Learning
[paper]
[poster]
Mark Hinds, Michael Geyer, Natalie Klein |
| 114 | MRI Parameters Mapping via Gaussian Mixture VAE: Breaking the Assumption
of Independent Pixels
[paper]
[poster]
Moucheng Xu, Yukun Zhou, Tobias Goodwin-Allcock, Kimia Firoozabadi, Joseph Jacob, Daniel C. Alexander, Paddy J. Slator |
| 115 | Evolutionary and Transformer based methods for Symbolic
Regression
[paper]
[poster]
Samyak Jha, Sergei Gleyzer, Eric A. F. Reinhardt, Victor Baules, Francois Charton, Nobuchika Okada |
| 117 | MATEY: multiscale adaptive foundation models for spatiotemporal physical
systems
[paper]
[poster]
Pei Zhang, M. Paul Laiu, Matthew R Norman, Doug Stefanski, John Gounley |
| 118 | S-KANformer: Enhancing Transformers for Symbolic Calculations in High
Energy Physics
[paper]
[poster]
Ritesh Bhalerao, Eric A. F. Reinhardt, Sergei Gleyzer, Nobuchika Okada, Victor Baules |
| 119 | Deep Multimodal Representation Learning for Stellar Spectra
[paper]
[poster]
Tobias Buck, Christian Schwarz |
| 120 | History-Matching of Imbibition Flow in Multiscale Fractured Porous Media
Using Physics-Informed Neural Networks (PINNs)
[paper]
[poster]
Jassem Abbasi, Ben Moseley, Takeshi Kurotori, Ameya D. Jagtap, Anthony Kovscek, Aksel Hiorth, Pål Østebø Andersen |
| 121 | Domain-Adaptive ML for Surface Roughness Predictions in Nuclear
Fusion
[paper]
[poster]
Shashank Galla, Antonios Alexos, Jay Phil Yoo, Junze Liu, Kshitij Bhardwaj, Sean Hayes, Monika Biener, Pierre Baldi, Satish Bukkapatnam, Suhas Bhandarkar |
| 122 | Estimating Dark Matter Halo Masses in Simulated Galaxy Clusters with
Graph Neural Networks
[paper]
[poster]
Nikhil Garuda, John F Wu, Dylan Nelson, Annalisa Pillepich |
| 123 | DeepUQ: Assessing the Aleatoric Uncertainties from two Deep Learning
Methods
[paper]
[poster]
Rebecca Nevin, Brian Nord, Aleksandra Ciprijanovic |
| 124 | Unsupervised Physics-Informed Super-Resolution of Strong Lensing Images
for Sparse Datasets
[paper]
[poster]
Anirudh Shankar, Michael W. Toomey, Sergei Gleyzer |
| 125 | Integrating Generative and Physics-Based Models for Ptychographic
Imaging with Uncertainty Quantification
[paper]
[poster]
Canberk Ekmekci, Tekin Bicer, Zichao (Wendy) Di, Junjing Deng, Mujdat Cetin |
| 127 | Video-Driven Graph Network-Based Simulators
[paper]
[poster]
Franciszek Szewczyk, Gilles Louppe, Matthia Sabatelli |
| 128 | Taylor Mode Neural Operators: Enhancing Computational Efficiency in
Physics-Informed Neural Operators
[paper]
[poster]
Anas Jnini, Flavio Vella |
| 130 | Neural Embeddings Evolve as Interacting Particles
[paper]
[poster]
Rohan Mehta, Ziming Liu, Max Tegmark |
| 131 | Point cloud diffusion models for the Electron-Ion Collider
[paper]
[poster]
Fernando Torales Acosta, Vinicius Mikuni, Felix Ringer, Nobuo Sato, Richard Whitehill |
| 133 | Galaxy Dust Maps with Conditional Score Models
[paper]
[poster]
Jared Siegel, Peter Melchior |
| 134 | A perspective on symbolic machine learning in physical sciences
[paper]
[poster]
Nour Makke, Sanjay Chawla Perspectives track |
| 135 | Physics-informed reduced order model with conditional neural
fields
[paper]
[poster]
Minji Kim, Tianshu Wen, Kookjin Lee, Youngsoo Choi |
| 137 | Geometry-aware PINNs for Turbulent Flow Prediction
[paper]
[poster]
Shinjan Ghosh, Julian Busch, Georgia Olympia Brikis, Biswadip Dey |
| 138 | Neural Entropy
[paper]
[poster]
Akhil Premkumar |
| 139 | Learning the Evolution of Physical Structure of Galaxies via Diffusion
Models
[paper]
[poster]
Andrew Lizarraga, Eric Hanchen Jiang, Jacob Nowack, Yun Qi Li, Ying Nian Wu, Bernie Boscoe, Tuan Do |
| 140 | FB-HyDON: Parameter-Efficient Physics-Informed Operator Learning of
Complex PDEs via Hypernetwork and Finite Basis Domain Decomposition
[paper]
[poster]
Milad Ramezankhani, Rishi Yash Parekh, Anirudh Deodhar, Dagnachew Birru |
| 141 | Towards Commercialization of Tokamaks: Time Series Viewmakers for Robust
Disruption Prediction
[paper]
[poster]
Dhruva Chayapathy, Tavis Siebert, Akshata Kishore Moharir, Lucas Spangher, Om Manoj Patil, Cristina Rea |
| 142 | Super-Resolution without High-Resolution label for Black Hole
Simulations
[paper]
[poster]
Thomas Helfer, Thomas Edwards, Jessica Dafflon, Kaze W. K. Wong, Matthew Lyle Olson |
| 143 | Reinforcement Learning for Optimal Control of Adaptive Cell Populations
[paper]
[poster]
Reproducibility badge 🏅 Josiah C Kratz, Jacob Adamczyk |
| 145 | Explainable Deep Learning Framework for SERS Bio-quantification
[paper]
[poster]
Jihan K. Zaki, Jakub Tomasik, Sabine Bahn, Jade A. McCune, Pietro Lio, Oren A. Scherman |
| 146 | Learning dictionaries of New Physics with sparse local kernels
[paper]
[poster]
Gaia Grosso, Philip Harris, Ekaterina Govorkova, Eric A. Moreno, Ryan Raikman |
| 148 | Multi-Wavelength Analysis of Kilonova Associated with GRB 230307A:
Accelerated Parameter Estimation and Model Selection Through Likelihood-Free
Inference
[paper]
[poster]
P. Darc, Clecio R. De Bom, Gabriel S. M. Teixeira, Charles Kilpatrick, Nora F. Sherman, Marcelo P. Albuquerque, Paulo Russano |
| 150 | Multidimensional Deconvolution with Profiling
[paper]
[poster]
Huanbiao Zhu, Mikael Kuusela, Larry Wasserman, Benjamin Nachman, Krish Desai, Vinicius Mikuni |
| 151 | A Physics-Informed Autoencoder-NeuralODE Framework (Phy-ChemNODE) for
Learning Complex Fuel Combustion Kinetics
[paper]
[poster]
[video] Tadbhagya Kumar, Pinaki Pal, Anuj Kumar |
| 152 | AICircuit: A Multi-Level Dataset and Benchmark for AI-Driven Analog
Integrated Circuit Design
[paper]
[poster]Reproducibility badge 🏅
Asal Mehradfar, Xuzhe Zhao, Yue Niu, Sara Babakniya, Mahdi Alesheikh, Hamidreza Aghasi, Salman Avestimehr Datasets & benchmarks track |
| 153 | Real-time Position Reconstruction for the KamLAND-Zen Experiment using
Hardware-AI Co-design
[paper]
[poster]
Alexander Migala, Eugene Ku, Zepeng Li, Aobo Li |
| 154 | Randomized reward redistribution for HPGe waveform classification under
weakly-supervised learning setup
[paper]
[poster]
Sonata Simonaitis-Boyd, Aobo Li |
| 156 | Systematic Uncertainties and Data Complexity in Normalizing
Flows
[paper]
[poster]
Sandip Roy, Yonatan Kahn, Jessie Shelton, Victoria Tiki |
| 157 | Exact and approximate error bounds for physics-informed neural
networks
[paper]
[poster]
Augusto T. Chantada, Pavlos Protopapas, Luca J. Gomez Bachar, Susana J. Landau, Claudia G. Scóccola |
| 158 | Machine Learning for Reparameterization of Multi-scale Closures
[paper]
[poster]
Hilary Egan, peter ciecielski, hariswaram sitaraman, megan crowley |
| 159 | Uncertainty Quantification From Scaling Laws in Deep Neural
Networks
[paper]
[poster]
Ibrahim Elsharkawy, Yonatan Kahn, Benjamin Hooberman |
| 160 | Reconstruction of Continuous Cosmological Fields from Discrete Tracers
with Graph Neural Networks
[paper]
[poster]
Yurii Kvasiuk, Jordan Krywonos, Matthew C. Johnson, Moritz Münchmeyer |
| 161 | Similarity-Quantized Relative Difference Learning for Improved Molecular
Activity Prediction
[paper]
[poster]
Karina Zadorozhny, Kangway V. Chuang, Bharath Sathappan, Ewan Wallace, Vishnu Sresht, Colin A Grambow |
| 162 | Joint cosmological parameter inference and initial condition
reconstruction with Stochastic Interpolants
[paper]
[poster]
Carolina Cuesta-Lazaro, Adrian E. Bayer, Michael Samuel Albergo, Siddharth Mishra-Sharma, Chirag Modi, Daniel J. Eisenstein |
| 163 | Product Manifold Machine Learning for Physics
[paper]
[poster]
Nathaniel S. Woodward, Sang Eon Park, Gaia Grosso, Jeffrey Krupa, Philip Harris |
| 165 | Equation-driven Neural Networks for Periodic Quantum Systems
[paper]
[poster]
Circe Hsu, Marios Mattheakis, Gabriel R Schleder, Daniel T. Larson |
| 166 | Differentiable Voxel-based X-ray Rendering Improves Sparse-View 3D CBCT
Reconstruction
[paper]
[poster]
[video] Mohammadhossein Momeni, Vivek Gopalakrishnan, Neel Dey, Polina Golland, Sarah Frisken |
| 167 | GFlowNets for Hamiltonian decomposition in groups of compatible
operators
[paper]
[poster]
Rodrigo Vargas-Hernandez, Isaac L. Huidobro-Meezs, Jun Dai, Guillaume Rabusseau |
| 168 | Symbolic regression for precision LHC physics
[paper]
[poster]
Manuel Morales-Alvarado, Josh Bendavid, Daniel Conde, Veronica Sanz, Maria Ubiali |
| 169 | An end-to-end generative model for heavy-ion collisions
[paper]
[poster]
Jing-An Sun |
| 170 | Using Variational Autoencoding to Infer the Masses of Exoplanets
Embedded in the Disks of Gas and Dust Orbiting Young Stars
[paper]
[poster]
[video] Sayed Shafaat Mahmud, Ramit Dey, Sayantan Auddy, Neal Turner, Jeffrey Bary |
| 171 | Neural Networks for Dissipative Physics Using Morse-Feshbach
Lagrangian
[paper]
[poster]
Veera Sundararaghavan, Jeff Simmons, Megna Shah |
| 175 | Transforming Simulation to Data Without Pairing
[paper]
[poster]
Eli Gendreau-Distler, Luc Tomas Le Pottier, Haichen Wang |
| 176 | Robust Emulator for Compressible Navier-Stokes using Equivariant
Geometric Convolutions
[paper]
[poster]
Wilson G. Gregory, David W Hogg, Kaze W. K. Wong, Soledad Villar |
| 177 | Neural Posterior Unfolding
[paper]
[poster]
Jingjing Pan, Benjamin Nachman, Vinicius Mikuni, Jay Chan, Krish Desai, Fernando Torales Acosta |
| 178 | Uncertainty Quantification for Surface Ozone Emulators using Deep
Learning
[paper]
[poster]
Kelsey Doerksen, Yuliya Marchetti, James Montgomery, Yarin Gal, Freddie Kalaitzis, Kazuyuki Miyazaki, Kevin Bowman, Steven Lu |
| 180 | AI Meets Antimatter: Unveiling Antihydrogen Annihilations
[paper]
[poster]
Ashley Ferreira, Mahip Singh, Andrea Capra, Ina Carli, Daniel Duque Quiceno, Wojciech T. Fedorko, Makoto Fujiwara, Muyan Li, Lars Martin, Yukiya Saito, Gareth Smith, Anqi Xu |
| 181 | Correcting misspecified score-based priors for inverse problems: An
application to strong gravitational lensing
[paper]
[poster]
Gabriel Missael Barco, Alexandre Adam, Connor Stone, Yashar Hezaveh, Laurence Perreault-Levasseur |
| 182 | Data-Driven, Parameterized Reduced-order Models for Predicting
Distortion in Metal 3D Printing
[paper]
[poster]
Indu Kant Deo, Youngsoo Choi, Saad Khairallah, Alexandre Reikher, Maria Strantza |
| 183 | Which bits went where? Past and future transfer entropy decomposition
with the information bottleneck
[paper]
[poster]
Kieran A. Murphy, Zhuowen Yin, Danielle Bassett |
| 185 | Variational Loss Landscapes for Periodic Orbits
[paper]
[poster]
Leo Yao, Ziming Liu, Max Tegmark |
| 188 | Amortizing intractable inference in diffusion models for Bayesian
inverse problems
[paper]
[poster]
Siddarth Venkatraman, Moksh Jain, Luca Scimeca, Minsu Kim, Marcin Sendera, Mohsin Hasan, Luke Rowe, Sarthak Mittal, Pablo Lemos, Emmanuel Bengio, Alexandre Adam, Jarrid Rector-Brooks, Yashar Hezaveh, Laurence Perreault-Levasseur, Yoshua Bengio, Glen Berseth, Nikolay Malkin |
| 189 | Interpreting Transformers for Jet Tagging
[paper]
[poster]
Aaron Wang, Abhijith Gandrakota, Elham E Khoda, Vivekanand Gyanchand Sahu, Javier Duarte, Priyansh Bhatnagar, Jennifer Ngadiuba |
| 190 | Learning Conformal Field Theory with Symbolic Regression: Recovering the
Symbolic Expressions for the Energy Spectrum
[paper]
[poster]
Haotian Cao, Garrett W. Merz, Kyle Cranmer, Gary Shiu |
| 191 | Bumblebee: Foundation Model for Particle Physics Discovery
[paper]
[poster]
Andrew J. Wildridge, Jack P. Rodgers, Mia Liu, Yao yao, Andreas W. Jung, Ethan M. Colbert |
| 193 | Robust one-shot spectroscopic multi-component gas mixture detection via
randomized smoothing
[paper]
[poster]
Mohamed Sy, Emad Al Ibrahim, Aamir Farooq |
| 194 | Conditional Diffusion Models for Generating Images of SDSS-Like
Galaxies
[paper]
[poster]
Mikaeel Yunus, John F Wu, Timothy Heckman, Benne W Holwerda |
| 198 | Dissipativity-Informed Learning for Chaotic Dynamical Systems with
Attractor Characterization
[paper]
[poster]
Sunbochen Tang, Themistoklis Sapsis, Navid Azizan |
| 199 | No Location Left Behind: Introducing the Fairness Assessment for
Implicit Representations of Earth Data
[paper]
[poster]
Daniel Cai, Randall Balestriero |
| 200 | GeoWavelets: Spherical Wavelets for Fair Implicit Representations of
Earth Data
[paper]
[poster]
Daniel Cai, Randall Balestriero |
| 201 | Graph rewiring for long range-aware protein learning
[paper]
[poster]
Ali Hariri, Pierre Vandergheynst |
| 202 | Unpaired Translation of Point Clouds for Modeling Detector
Response
[paper]
[poster]
Mingyang Li, Curtis Hunt, Michelle P. Kuchera, Raghuram Ramanujan, Yassid Ayyad, Adam K. Anthony |
| 203 | Convolutional Vision Transformer for Cosmology Parameter
Inference
[paper]
[poster]
Yash Gondhalekar, Kana Moriwaki |
| 204 | Zephyr quantum-assisted hierarchical Calo4pQVAE for particle-calorimeter
interactions
[paper]
[poster]
Ian Lu, Hao Jia, Sebastian Gonzalez, Deniz Sogutlu, Javier Toledo, Sehmimul Hoque, Abhishek Abhishek, Colin Gay, Roger Melko, Eric Paquet, Geoffrey Fox, Maximilian Swiatlowski, Wojciech T. Fedorko |
| 206 | Generation of Air Shower Images for Imaging Air Cherenkov Telescopes
using Diffusion Models
[paper]
[poster]
Christian Elflein, Stefan Funk, Jonas Glombitza, Vinicius Mikuni, Benjamin Nachman, Lark Wang |
| 207 | WOTAN: Weakly-supervised Optimal Transport Attention-based Noise
Mitigation
[paper]
[poster]
Nathan Suri, Vinicius Mikuni, Benjamin Nachman |
| 208 | Discovering How Ice Crystals Grow Using NODE's and Symbolic
Regression
[paper]
[poster]
Kara D Lamb, Jerry Harrington |
| 209 | Learning Locally Adaptive Metrics that Enhance Structural Representation
with $\texttt{LAMINAR}$
[paper]
[poster]
Christian Kleiber, William H. Oliver, Tobias Buck |
| 211 | Virtual Reality for Understanding Artificial-Intelligence-driven
Scientific Discovery with an Application in Quantum Optics
[paper]
[poster]
Philipp Schmidt, Carlos Ruiz-Gonzalez, Sören Arlt, Xuemei Gu, Carla Rodríguez, Mario Krenn |
| 212 | Clifford Flows
[paper]
[poster]
Francesco Alesiani, Takashi Maruyama |
| 214 | OrbNet-Spin: Quantum Mechanics Informed Geometric Deep Learning For
Open-shell Systems
[paper]
[poster]
Beom Seok Kang, Mohammadamin Tavakoli, Vignesh C Bhethanabotla, William Goddard, Anima Anandkumar |
| 215 | Bayesian Deconvolution of Astronomical Images with Diffusion Models:
Quantifying Prior-Driven Features in Reconstructions
[paper]
[poster]
[video] Alessio Spagnoletti, Marc Huertas-Company, Alexandre Boucaud, Wassim Kabalan, Biswajit Biswas |
| 216 | Topological data analysis of large swarming dynamics
[paper]
[poster]
Yoh-ichi Mototake, Shinichi Ishida, Norihiro Maruyama, Takashi Ikegami |
| 217 | Shaping Flames with Differentiable Physics Simulations
[paper]
[poster]
Laura Leja, Karlis Freivalds, Oskars Teikmanis |
| 221 | Flow Annealed Importance Sampling Bootstrap meets Differentiable
Particle Physics
[paper]
[poster]
Annalena Kofler, Vincent Stimper, Mikhail Mikhasenko, Michael Kagan, Lukas Heinrich |
| 222 | Learning Symmetry-Independent Jet Representations via Jet-Based Joint
Embedding Predictive Architecture
[paper]
[poster]
Subash Katel, Haoyang Li, Zihan Zhao, Javier Duarte |
| 224 | Hybrid Summary Statistics
[paper]
[poster]
[video] T. Lucas Makinen, Ce Sui, Benjamin Dan Wandelt |
| 225 | Testing Uncertainty of Large Language Models for Physics Knowledge and
Reasoning
[paper]
[poster]
Elizaveta Reganova, Peter Steinbach |
| 226 | Uncertainty quantification for fast reconstruction methods using
augmented equivariant bootstrap: Application to radio
interferometry
[paper]
[poster]
Mostafa Cherif, Tobías I. Liaudat, Jonathan Kern, Christophe Kervazo, Jerome Bobin |
| 227 | Loss function to optimise signal significance in particle
physics
[paper]
[poster]
Jai Bardhan, Cyrin Neeraj, Subhadip Mitra, Tanumoy Mandal |
| 228 | Probabilistic Galaxy Field Generation with Diffusion Models
[paper]
[poster]
Tanner Sether, Elena Giusarma, Mauricio Reyes |
| 230 | Unravelling Ion-Scale Coherent Structures in the Solar Wind with Machine
Learning
[paper]
[poster]
Yufei Yang |
| 231 | 3D-PDR Orion dataset and NeuralPDR: Neural Differential Equations for
Photodissociation Regions
[paper]
[poster]
Gijs Vermariën, Serena Viti, Rahul Ravichandran, Thomas G. Bisbas Datasets & benchmarks track |
| 234 | A Platform, Dataset, and Challenge for Uncertainty-Aware Machine
Learning
[paper]
[poster]
David Rousseau, Wahid Bhimji, Ragansu Chakkappai, Steven Farrell, Aishik Ghosh, Isabelle Guyon, Chris Harris, Elham E Khoda, Benjamin Nachman, Ihsan Ullah, Sascha Diefenbacher, Yuan-Tang Chou, Paolo Calafiura, Yulei Zheng, Jordan Dudley |
| 235 | Mean-Field Simulation-Based Inference for Cosmological Initial
Conditions
[paper]
[poster]
Oleg Savchenko, Florian List, Noemi Anau Montel, Christoph Weniger, Guillermo Franco Abellan |
| 237 | Towards long rollout of neural operators with local attention and flow
matching-inspired correction: An example in frontal polymerization
PDEs
[paper]
[poster]
Pengfei Cai, Sulin Liu, Qibang Liu, Philippe Geubelle, Rafael Gomez-Bombarelli |
| 239 | Simulation-based inference with scattering representations: scattering
is all you need
[paper]
[poster]
Kiyam Lin, Benjamin Joachimi, Jason McEwen |
| 240 | CURIE: Evaluating LLMs on Multitask Scientific Long-Context
Understanding and Reasoning
[paper]
[poster]
Hao Cui, Zahra Shamsi, Xuejian Ma, Gowoon Cheon, Shutong Li, Maria Tikhanovskaya, Nayantara Mudur, Martyna Beata Plomecka, Peter Christian Norgaard, Paul Raccuglia, Victor V. Albert, Yasaman Bahri, Pranesh Srinivasan, Haining Pan, Philippe Faist, Brian A Rohr, Michael J. Statt, Dan Morris, Drew Purves, Elise Kleeman, Ruth Alcantara, Matthew Abraham, Muqthar Mohammad, Ean Phing VanLee, Chenfei Jiang, Elizabeth Dorfman, Eun-Ah Kim, Michael Brenner, Sameera S Ponda, Subhashini Venugopalan Datasets & benchmarks track |
| 241 | Differentiable Conservative Radially Symmetric Fluid Simulations and Stellar Winds $\circ$ jf1uids
[paper]
[poster]
Reproducibility badge 🏅 Leonard Storcks, Tobias Buck |
| 242 | Port-Hamiltonian Neural Networks for Learning Coupled Systems and Their
Interactions
[paper]
[poster]
Razmik Arman Khosrovian, Takaharu Yaguchi, Takashi Matsubara |
| 244 | Harnessing Machine Learning for Single-Shot Measurement of Free Electron Laser Pulse Power
[paper]
[poster]
Reproducibility badge 🏅 Till Korten, Vladimir Rybnikov, Mathias Vogt, Juliane Roensch-Schulenburg, Peter Steinbach, Najmeh Mirian |
| 246 | Quantum Wasserstein Compilation: Unitary Compilation using the Quantum
Earth Mover's Distance
[paper]
[poster]
Marvin Richter, Abhishek Y. Dubey, Axel Plinge, Christopher Mutschler, Daniel Scherer, Michael Hartmann |
| 247 | RoBo6: Standardized MMT Light Curve Dataset for Rocket Body
Classification
[paper]
[poster]
Daniel Kyselica, Marek Suppa, Jiří Šilha, Roman Ďurikovič Datasets & benchmarks track |
| 248 | fBm-Based Generative Inpainting for the Reconstruction of Chromosomal
Distances
[paper]
[poster]
Alexander Lobashev, Dmitry Guskov, Kirill Polovnikov |
| 249 | Enhancing Molecular Expressiveness through Multi-View
Representations
[paper]
[poster]
Indra Priyadarsini, Seiji Takeda, Lisa Hamada, Hajime Shinohara |
| 251 | SE(3) Equivariant Topologies for Structure-based Drug Discovery
[paper]
[poster]
Alvaro Prat, Hisham Abdel Aty, Aurimas Pabrinkis, Orestis Bastas, Tanya Paquet, Gintautas Kamuntavičius, Roy Tal |
| 252 | Fine-tuning Foundation Models for Molecular Dynamics: A Data-Efficient
Approach with Random Features
[paper]
[poster]
Pietro Novelli, Luigi Bonati, Pedro J. Buigues, Giacomo Meanti, Lorenzo Rosasco, Michele Parrinello, massimiliano pontil |
| 253 | Diffusion-Based Inverse Solver on Function Spaces With Applications to
PDEs
[paper]
[poster]
Abbas Mammadov, Julius Berner, Kamyar Azizzadenesheli, Jong Chul Ye, Anima Anandkumar |
| 254 | PINNfluence: Influence Functions for Physics-Informed Neural Networks
[paper]
[poster]
Reproducibility badge 🏅 Jonas Naujoks, Aleksander Krasowski, Moritz Weckbecker, Thomas Wiegand, Sebastian Lapuschkin, Wojciech Samek, René Pascal Klausen |
| 255 | 3D Cloud reconstruction through geospatially-aware Masked
Autoencoders
[paper]
[poster]
Stella Girtsou, Emiliano Diaz, Lilli Freischem, Joppe Massant, Kyriaki-Margarita Bintsi, Giuseppe Castiglione, William Jones, Michael Eisinger, Juan Emmanuel Johnson, Anna Jungbluth |
| 257 | Speak so a physicist can understand you! TetrisCNN for detecting phase
transitions and order parameters
[paper]
[poster]
[video] Kacper Cybiński, James Enouen, Antoine Georges, Anna Dawid |
| 258 | Score-based models for 1/f correlated noise correction in James Webb
Space Telescope spectral data
[paper]
[poster]
Salma Salhi, Alexandre Adam, Loic Albert, Rene Doyon, Laurence Perreault-Levasseur |
| 259 | PolarBERT: A Foundation Model for IceCube
[paper]
[poster]
Inar Timiryasov, Jean-Loup Tastet, Oleg Ruchayskiy |
| 260 | Open-Source Molecular Processing Pipeline for Generating
Molecules
[paper]
[poster]
Shreyas V, Jose Siguenza, Karan Bania, Bharath Ramsundar |
| 261 | Jrystal: A JAX-based Differentiable Density Functional Theory Framework
for Materials
[paper]
[poster]
Tianbo Li, Zekun Shi, Stephen Gregory Dale, Giovanni Vignale, Min Lin |
| 262 | Sharing Space: A Survey-agnostic Variational Autoencoder for Supernova
Science
[paper]
[poster]
Kaylee de Soto, Ana Sofia Uzsoy, V Ashley Villar |
| 264 | Diffusion-Based Inpainting of Corrupted Spectrogram
[paper]
[poster]
Mahsa Massoud, Reyhane Askari-Hemmat, Kai-Feng Chen, Adrian Liu, Siamak Ravanbakhsh |
| 266 | Tomographic SAR Reconstruction for Forest Height Estimation
[paper]
[poster]
Grace Beaney Colverd, Jumpei Takami, Laura Schade, Karol Bot, Joseph Alejandro Gallego Mejia |
| 267 | Hamiltonian Learning using Machine Learning Models Trained with
Continuous Measurements
[paper]
[poster]
Amit Kiran Rege, Kris Tucker, Conor Smith, Claire Monteleoni |
| 269 | Data-Driven Reweighting for Monte Carlo Simulations
[paper]
[poster]
Ahmed Youssef, Christian Bierlich, Phil Ilten, Tony Menzo, Stephen Mrenna, Manuel Szewc, Michael K. Wilkinson, Jure Zupan |
| 270 | A multi-composition reinforcement learning framework for isomer
discovery in 3D
[paper]
[poster]
Bjarke Hastrup, François R J Cornet, Tejs Vegge, Arghya Bhowmik |
A small number of paper marked with Reproducibility badge 🏅 are highlighted to reflect code/dataset availability and methodological clarity, showcasing a high standard of reproducibility.
Program Committee (Reviewers)
We acknowledge the 333 members of the program committee for providing reviews on a very tight schedule and making this workshop possible. They are listed in alphabetical order below.
Abhijeet Parida (Childrens National Medical ), Abhijith Gandrakota (Fermi National Accelerator Laboratory (Fermilab)), Abhinanda Ranjit Punnakkal (University of Tromsø), Abhishek Abhishek (University of British Columbia), Abhishek Chandra (Eindhoven University of Technology), Abhishikth Mallampalli (University of Wisconsin - Madison), Adrian Perez-Suay (Universidad de Valencia), Agnimitra Dasgupta (University of Southern California), Ahmed MAZARI (Ansys, SimAI team), Ahmed Youssef (University of Cincinnati), Aidan Durr Chambers (Harvard University), Aizhan Akhmetzhanova (Harvard University, Harvard University), Alex Sun (University of Texas at Austin), Alexander Migala (University of California, San Diego), Alexander Thomas Gagliano (Massachusetts Institute of Technology), Alexandre Adam (Université de Montréal), Alexandre Strube (Forschungszentrum Juelich GmbH), Aman Desai (University of Adelaide), AmirEhsan Khorashadizadeh (University of Basel), Amit Kumar Jaiswal (University of Surrey), Anant Wairagade (IEEE Phoenix), Andrew Stevens (OptimalSensing), Andrey A Popov (University of Hawaii at Manoa), Ankita Shukla (University of Nevada, Reno), Anna Dawid (Leiden University, Leiden University), Anna Jungbluth (European Space Agency), Annalena Kofler (Max-Planck Institute), Antonin Sulc (Universität Konstanz), Arvind Mohan (Los Alamos National Laboratory), Arvind Ramanathan (Argonne National Laboratory), Arvind Renganathan (University of Minnesota - Twin Cities), Asal Mehradfar (University of Southern California), Athénaïs Gautier (McGill University), Atul Agrawal (Technische Universität München), Bariscan Kurtkaya (Stanford University), Benjamin Nachman (Lawrence Berkeley National Lab), Benjamin Y. J. Wong (National University of Singapore), Bharath Ramsundar (Deep Forest Sciences), Bilal Thonnam Thodi (New York University), Biprateep Dey (University of Pittsburgh), Biswarup Bhattacharya (Citadel), Biwei Dai (University of California Berkeley), Brian Nord (Fermi National Accelerator Laboratory), Bruno Raffin (INRIA), Carolina Cuesta-Lazaro (Massachusetts Institute of Technology), Cenk Tüysüz (DESY), Cheng Soon Ong (Australian National University), Chenyang Li (Argonne National Laboratory), Christine Allen-Blanchette (Princeton University), Christoph Weniger (University of Amsterdam), Christopher C. Hall (RadiaSoft LLC), Claire David (African Institute for Mathematical Sciences (South Africa)), Claudius Krause (HEPHY), Conrad M Albrecht (Columbia University), Constantin Weisser (Massachusetts Institute of Technology), Daniel Serino (Los Alamos National Laboratory), Danyal Rehman (Mila - Quebec Artificial Intelligence Institute), David Rousseau (IJCLab), Deep Chatterjee (Massachusetts Institute of Technology), Devesh Upadhyay (Saab ), Dimitra Maoutsa (Technische Universität München), Dongjin Seo (Yale University), Duccio Pappadopulo (Bloomberg), Edward Berman (Northeastern University), Elham E Khoda (University of California, San Diego), Eliane Maalouf (Université de Neuchâtel), Elise Özalp (Imperial College London), Elyssa Hofgard (Massachusetts Institute of Technology), Emanuele Usai (The University of Alabama), Engin Eren (Universität Hamburg), Enrico Rinaldi (Quantinuum), Eric Metodiev (Renaissance), Fabian Ruehle (Northeastern University), Fadoua Khmaissia (Bell Labs), Fatih Dinc (University of California, Santa Barbara), Favour Nerrise (Stanford University), Felix Wagner (ETHZ - ETH Zurich), Feng Chen (Stanford University), Fernando Torales Acosta (Lawrence Berkeley National Lab), Feyi Olalotiti (Intel), Francesco Alesiani (NEC), Francisco Villaescusa-Navarro (Princeton University), Franco Pellegrini (International School for Advanced Studies Trieste), Francois Lanusse (CNRS), François Gygi (University of California, Davis), François Rozet (Université de Liège), Gabriel Perdue (Fermi National Accelerator Laboratory), Gadi Naveh (GSK plc), Gaia Grosso (Massachusetts Institute of Technology), Gal Oren (Stanford University), Garrett W. Merz (University of Wisconsin - Madison), Gemma Zhang (Harvard University), George Stein (Layer6 AI), Georges Tod (University Paris Descartes), Gergana V. Velikova (PASQAL), Gert-Jan Both (HHMI Janelia Research Campus), Gijs Vermariën (Leiden Observatory, Leiden University), Gilles Louppe (University of Liège), Gregory Mermoud (HES-SO : UAS Western Switzerland), Gustau Camps-Valls (Universitat de València), H H C (University of California, Merced), Haimeng Zhao (California Institute of Technology), Haodong Feng (Westlake University), Haowei Ni (Johnson and Johnson), Haoxuan Chen (Stanford University), Haoyang Zheng (Purdue University), Harold Erbin (CEA), Henning Kirschenmann (University of Helsinki), Huichi Zhou (Imperial College London), Hunor Csala (University of Utah), Inbar Savoray (University of California, Berkeley), Indu Kant Deo (University of British Columbia), Irina Espejo Morales (International Business Machines), Ivan Grega (University of Cambridge), Jack Collins (Bosch), Jacob A Zwart (U.S. Geological Survey), Jacob Adamczyk (University of Massachusetts Boston), Jan Olle (Max Planck Institute for the Science of Light), Jason McEwen (University College London), Jay Chan (Lawrence Berkeley National Lab), Jay Taneja (University of Massachusetts at Amherst), Jean-roch Vlimant (California Institute of Technology), Jenna Pope (Pacific Northwest National Laboratory), Jeongwhan Choi (Yonsei University), Jesse Thaler (Massachusetts Institute of Technology), Jiahe Huang (University of Michigan - Ann Arbor), Jiajing Chen (New York University), Jianjun Hu (University of South Carolina), Jie Gao (Rutgers University), Jihan K. Zaki (University of Cambridge), Jingjing Pan (Yale University), Jingyi Tang (Stanford University), Jochen Garcke (University of Bonn), Joel Dabrowski (Data61, CSIRO), Johan de Kleer (c-infinity), John F Wu (Space Telescope Science Institute), Jordi Tura (Leiden University), Jose Francisco Ruiz-Munoz (Universidad Nacional de Colombia), Jose Manuel Napoles-Duarte (Universidad Autónoma de Chihuahua), Joseph Alejandro Gallego Mejia (Drexel University), Joshua Isaacson (Fermi National Accelerator Laboratory), Joshua Yao-Yu Lin (Prescient Design/ Genentech), Junichi Tanaka (International Center for Elementary Particle Physics, The University of Tokyo), Junze Liu (University of California, Irvine), Kai Fukami (University of California, Los Angeles), Karolos Potamianos (University of Oxford), Kartik Mathur (Microsoft), Katherine Fraser (University of California, Berkeley), Kathleen Champion (Amazon), Keith Brown (Boston University, Boston University), Keming Zhang (University of California Berkeley), Kieran A Murphy (University of Pennsylvania), Kim Andrea Nicoli (Rheinische Friedrich-Wilhelms Universität Bonn), Kiri Wagstaff (American Association for the Advancement of Science), Krish Desai (University of California, Berkeley), Kyongmin Yeo (International Business Machines), Kyriakos Flouris (Swiss Federal Institute of Technology), Lalit Ghule (Ansys Inc), Lars Doorenbos (Universität Bern), Leander Thiele (Princeton University), Line H Clemmensen (Technical University of Denmark), Lingxiao Wang (RIKEN), Lipi Gupta (Lawrence Berkeley National Lab), Luc Tomas Le Pottier (University of California, Berkeley), Lucas Thibaut Meyer (INRIA), Ludger Paehler (Technical University Munich), MD SAJID (Indian Institute of Technology Indore), MUHAMMAD AMIN NADIM (University of Pegaso), Madhurima Nath (Virginia Polytechnic Institute and State University), Mahsa Massoud (McGill University, McGill University), Mai H Nguyen (University of California, San Diego), Maithili Bhide (University of California, Los Angeles), Mallikarjuna Tupakula (Rochester Institute of Technology), Marco Letizia (University of Genoa), Maria Piles (Universidad de Valencia), Mariano Javier de Leon Dominguez Romero (Universidad Nacional de Córdoba), Mariel Pettee (Lawrence Berkeley National Lab), Marimuthu Kalimuthu (Universität Stuttgart), Marina Meila (University of Washington, Seattle), Mario Krenn (Max Planck Institute for the Science of Light), Marios Mattheakis (Harvard University), Matija Medvidović (ETHZ - ETH Zurich), Matiwos Mebratu (Stanford University), Matt L. Sampson (Princeton University), Matteo Manica (International Business Machines), Maximilian Dax (Max-Planck Institute), Maxwell Xu Cai (SURF Corporative), Micah Bowles (University of Oxford), Michael Deistler (University of Tuebingen), Mike Williams (Massachusetts Institute of Technology), Milind Malshe (Georgia Institute of Technology), Mira Moukheiber (Massachusetts Institute of Technology), Mohammad Shahab Sepehri (University of Southern California), Mohammadamin Tavakoli (California Institute of Technology), Mohannad Elhamod (Virginia Polytechnic Institute and State University), Mridul Khurana (Virginia Polytechnic Institute and State University), Nadim Saad (Northeastern University), Natalie Klein (Los Alamos National Laboratory), Nayantara Mudur (Harvard University), Neel Chatterjee (Intel), Neerav Kaushal (Sail Biomedicines), Negin Forouzesh (California State University, Los Angeles), Nesar Soorve Ramachandra (Argonne National Laboratory), Nick McGreivy (Princeton University), Nicolò Oreste Pinciroli Vago (Polytechnic Institute of Milan), Nils Thuerey (Technical University Munich), Noemi Anau Montel (University of Amsterdam), Olivier Saut (CNRS), Ori Linial (Technion - Israel Institute of Technology, Technion), Othmane Rifki (DESY), Pao-Hsiung Chiu (Institute of High Performance Computing, Singapore, A*STAR), Pedro L. C. Rodrigues (Inria), Peer-timo Bremer (University of Utah), Peimeng Guan (Georgia Institute of Technology), Peter McKeown (CERN), Peter Melchior (Princeton University), Peter Nugent (University of Oklahoma), Peter Steinbach (Helmholtz-Zentrum Dresden-Rossendorf), Phaedon Stelios Koutsourelakis (Technische Universität München), Phan Nguyen (Lawrence Livermore National Labs), Pierre Thodoroff (University of Cambridge), Pietro Vischia (Universidad de Oviedo), Pim De Haan (University of Amsterdam), Pradyun Hebbar (Lawrence Berkeley National Lab), Progyan Das (Indian Institute of Technology, Gandhinagar), Qi Tang (Georgia Institute of Technology), Qiaohao Liang (Massachusetts Institute of Technology), Rafael Gomez-Bombarelli (Massachusetts Institute of Technology), Raghav Kansal (CERN), Raheem Karim Hashmani (University of Wisconsin - Madison), Rahul Ghosh (University of Minnesota, Minneapolis), Rama Vasudevan (Oak Ridge National Laboratory), Rasmus F. Ørsøe (Technische Universität München), Redouane Lguensat (Institut Pierre-Simon Laplace), Remmy Zen (Max Planck Institute for the Science of Light), Reza Akbarian Bafghi (University of Colorado at Boulder), Rhys Goodall (Chemix Inc.), Ricardo Vinuesa (KTH Royal Institute of Technology), Richard M. Feder (University of California, Berkeley), Rikab Gambhir (Massachusetts Institute of Technology), Roberto Bondesan (Imperial College London), Rodrigo Vargas-Hernandez (McMaster University), Rohan Venkat (University of Chicago), Ronan Legin (Université de Montréal), Rutuja Gurav (University of California, Riverside), Ryan Hausen (Johns Hopkins University), Sam Foreman (Argonne National Laboratory), Samson J Koelle (Amazon), Sandeep Madireddy (Argonne National Laboratory), Sankalp Gilda (DevelopYours), Sarvesh Gharat (Indian Institute of Technology, Bombay), Sarvesh Kumar Yadav (Raman Research Institute), Sascha Caron (Radboud University Nijmegen), Savannah Jennifer Thais (Columbia University), Sebastian Dorn (Technical University of Applied Sciences Augsburg), Sebastian Kaltenbach (ETHZ - ETH Zurich), Shaokai Yang (University of Alberta), Shaoming Xu (University of Minnesota - Twin Cities), Shashank Galla (Texas A&M University - College Station), Shixiao Liang (Rice University), Shiyu Wang (Emory University), Shriram Chennakesavalu (Stanford University), Shubhendu Trivedi (Massachusetts Institute of Technology), Siddhant Midha (Princeton University), Siddharth Mishra-Sharma (MIT), Sifan Wang (Yale University), Sining Huang (University of California, Berkeley), Sirisha Rambhatla (University of Waterloo), Somya Sharma (University of Minnesota - Twin Cities), Soronzonbold OTGONBAATAR (Ludwig-Maximilians-Universität München), Sreevani Jarugula (Fermilab), Srinadh Reddy Bhavanam (Clemson University), Srinandan Dasmahapatra (University of Southampton), Stefan M. Wild (Lawrence Berkeley National Lab), Stephan Günnemann (Technical University Munich), Stephen Zhang (University of Melbourne), Sudhakar Pamidighantam (Georgia Institute of Technology), Sui Tang (UC Santa Barbara), Sunbochen Tang (Massachusetts Institute of Technology), Supranta Sarma Boruah (University of Pennsylvania, University of Pennsylvania), Taniya Kapoor (Delft University of Technology), Taoli Cheng (University of Montreal), Tarun Kumar (Hewlett Packard Enterprise), Tatiana Likhomanenko (Apple), Thomas Beckers (Vanderbilt University), Tianji Cai (SLAC National Accelerator Laboratory), Tiffany Fan (Stanford University), Till Korten (Helmholtz Zentrum Dresden Rossendorf (HZDR)), Tobias Buck (Heidelberg University, Ruprecht-Karls-Universität Heidelberg), Tomo Lazovich (U.S. Census Bureau), Tri Nguyen (Massachusetts Institute of Technology), Tristan Cazenave (Université Paris-Dauphine (Paris IX)), Udit Bhatia (IIT Gandhinagar, Dhirubhai Ambani Institute Of Information and Communication Technology), V Ashley Villar (Harvard University), Vahe Gharakhanyan (Facebook), Vignesh C Bhethanabotla (California Institute of Technology), Vinicius Mikuni (Lawrence Berkeley National Lab), Vishal Dey (Ohio State University, Columbus), Vishwa Pardeshi (Fidelity Investments), Vitus Benson (Max-Planck-Institute for Biogeochemistry), Volkan Kumtepeli (University of Oxford), Vudtiwat Ngampruetikorn (University of Sydney), Wai Tong Chung (Together AI), Wenhao Lu (Universität Hamburg), Wonmin Byeon (NVIDIA), Xian Yeow Lee (Hitachi America Ltd.), Xiang Li (University of Minnesota - Twin Cities), Xiao-Yong Jin (Argonne National Laboratory), Xiaowei Jia (University of Pittsburgh), Xihaier Luo (Brookhaven National Laboratory), Xinyan Li (IQVIA), Yangzesheng Sun (Meshy AI), Yannik Glaser (University of Hawaii at Manoa), Yao Fehlis (Advanced Micro Devices), Yilin Chen (Stanford University), Yin Li (Peng Cheng Laboratory), Yingtao Luo (CMU, Carnegie Mellon University), Yiran Wang (Xidian University), Yitian Sun (McGill University), Yixiao Kang (Facebook), Yiyi Tao (ByteDance Inc.), Youngwoo Cho (Korea Advanced Institute of Science and Technology), Yuan Yin (Valeo), Yuanqing Wang (New York University), Yukun Song (University of California, Berkeley), Yunxuan Li (Google), Zefang Liu (Georgia Institute of Technology), Zhe Jiang (University of Florida), Zhida Huang (ByteDance Inc.), Zhuo Chen (Massachusetts Institute of Technology), Ziming Liu (Massachusetts Institute of Technology), Zixing Song (The Chinese University of Hong Kong), Zixuan Wang (CMU, Carnegie Mellon University)
Awards
Best Paper Awards 🏅
Sponsored by Apple. Awardees get an iPhone 16 Pro.
Wilson G. Gregory, David W Hogg, Kaze W. K. Wong, Soledad Villar
[paper]
Reproducibility Awards 🏅
Sponsored by Foundry. Awardees (drawn at-random from accepted papers with a reproducibility badge) get $2,000 GPU cloud computing credits.
Asal Mehradfar, Xuzhe Zhao, Yue Niu, Sara Babakniya, Mahdi Alesheikh, Hamidreza Aghasi, Salman Avestimehr
[paper] [poster]
Outstanding Reviewer Awards 🏅
Sponsored by Foundry. Awardees get $2,000 GPU cloud computing credits.
University of Melbourne
University of Cambridge
Travel Support
Sponsored by The NSF AI Institute for Artificial Intelligence and Fundamental Interactions (IAIFI), Machine Learning: Science and Technology, Data Science Institute, University of Wisconsin-Madison, APS Topical Group on Data Science, and Renaissance Technologies, paying for the cost of NeurIPS workshop registration for 27 awardees.
Call for external contributions
In this workshop, we aim to bring together physical scientists and machine learning researchers who work at the intersection of these fields by
- applying machine learning to problems in the physical sciences -- physics, chemistry, astronomy, earth science, biophysics, and related sciences; and
- using physical insights to understand and/or improve machine learning techniques, for instance building hybrid machine learning algorithms that leverage physical models with machine learning blocks to create interpretable and accurate predictive models.
To this end, we encourage external contributions, which will be presented during in-person poster sessions during the workshop. Selected contributions will be offered 15-minute contributed talks. We invite researchers to submit original work in the following areas or areas related to them:
- ML for Physics: Innovative applications of machine learning to the physical sciences; Machine learning model interpretability for obtaining insights into physical systems; Automating/accelerating elements of the scientific process (experimental design, data collection, statistical analysis, etc.).
- Physics in ML: Strategies for incorporating scientific knowledge or methods into machine learning models and algorithms; Applications of physical science methods and processes to understand, model, and improve machine learning models and algorithms.
- Other areas: Any other area related to the subject of the workshop, including but not limited to probabilistic methods that are relevant to physical systems, such as deep generative models, scientific foundation models, probabilistic programming, simulation-based inference, variational inference, causal inference, etc.
Submission tracks
- Research abstract: We invite contributions on either completed or high-quality work-in-progress original research on the topics outlined above.
- Datasets & Benchmarks abstract: We invite contributions describing a dataset and/or corresponding benchmarks at the intersection of ML and Physical Sciences, in particular showcasing the unique nature of physical datasets and forward models in the context of ML applications. See submission and review guidelines for specific instructions relating to this track.
- Perspectives abstract: This year, we introduce a new Perspectives track, where researchers have the opportunity to present compelling and grounded viewpoints on recent directions and open questions at the intersection of ML and Physical Sciences. This track encourages disseminating perspectives on past, present, or future challenges of interest to scientists working at the intersection between ML and Physical Sciences. The track aims to stimulate productive and respectful conversations on timely topics that will benefit from the ML4PS workshop's attendees' input. Position papers should meet standard scientific rigor, including using evidence and reasoning to support claims, including relevant background and context, and attributing others' work via appropriate citations. Accepted Perspectives will be presented at the workshop during the poster sessions.
Submission instructions
Submissions should be anonymized short papers (extended abstracts) up to 4 pages excluding references. We invite authors to follow the guidelines and best practices from the NeurIPS conference (see also the main conference Datasets & Benchmarks call for guidelines pertaining to the corresponding track). Please ensure that your paper is approachable by someone not an expert in your specific area of physical science. For example, please avoid or at least define jargon. We reserve the right to desk reject any submissions that do not conform to the format. The review process is double-blind (optionally, single-blind for the Datasets & Benchmarks track). All authors must be registered as authors at the time of submission. We will not allow authors to be added after the review process has begun. This workshop is not archival so we will consider papers containing content that is published in an archival venue other than the main NeurIPS conference (e.g. a physics journal). However, such papers will likely need to be rewritten to fit the format and venue.
Submit your work on the submission portal. See submission and review guidelines for important instructions on preparing contributions as well as details on how they will be evaluated.
Submit contributions Submission guidelinesCode sharing & reproducibility guidance: While we do not enforce it, we will highlight submissions containing documented code and reproducible workflows through a Reproducibility Badge.
Double-submission policy: While we primarily encourage the submission of original pieces of work, we also accept submissions that are extended abstract versions of already published work if their topic fits particularly well with the workshop's scope. In contrast, with the objective of respecting the hard work of reviewers and giving equal chances to all submissions, we strictly prohibit submitting to multiple workshops simultaneously. Submissions flagged as coincidentally submitted to multiple NeurIPS workshops will be desk rejected.
Important dates
Organizers
For questions and comments, please contact us at ml4ps@googlegroups.com.
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Nicole HartmanTechnical University of Munich
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Vinicius MikuniLBNL / NERSC
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Siddharth Mishra-SharmaMIT / IAIFI / Boston University
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Mariel PetteeLBNL / Flatiron Institute
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Sebastian Wagner-CarenaNYU / Simons Foundation
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Antoine WehenkelApple
Steering Committee
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Atılım Güneş BaydinUniversity of Oxford
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Kyle CranmerUniversity of Wisconsin
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Brian NordFermilab
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Benjamin NachmanLBNL
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Savannah ThaisColumbia University
Location
NeurIPS 2024 will take place at the Vancouver Convention Center, 1055 Canada Pl, Vancouver, BC V6C 0C3, Canada.