NeurIPS 2023 Workshop AI4Science Submissions

Interpretable Neural PDE Solvers using Symbolic Frameworks
Yolanne Lee
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Role of Structural and Conformational Diversity for Machine Learning Potentials
Nikhil Shenoy, Prudencio Tossou, Emmanuel Noutahi, Hadrien Mary, Dominique Beaini, Jiarui Ding
- Published: 28 Oct 2023, Last Modified: 10 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Latent Neural PDE Solver for Time-dependent Systems
Zijie Li, Saurabh Patil, Dule Shu, Amir Barati Farimani
- Published: 28 Oct 2023, Last Modified: 14 Nov 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Vertical AI-driven Scientific Discovery
Yexiang Xue
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Learning Over Molecular Conformer Ensembles: Datasets and Benchmarks
Yanqiao Zhu, Jeehyun Hwang, Keir Adams, Zhen Liu, Bozhao Nan, Brock Stenfors, Yuanqi Du, Jatin Chauhan, Olaf Wiest, Olexandr Isayev, Connor Coley, Yizhou Sun, Wei Wang
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Adaptive learning acceleration for nonlinear PDE solvers
Vinicius Luiz Santos Silva, Pablo Salinas, Claire E Heaney, Matthew Jackson, Christopher Charles Pain
- Published: 28 Oct 2023, Last Modified: 21 Nov 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
ChemGymRL: An Interactive Framework for Reinforcement Learning for Digital Chemistry
Chris Beeler, Sriram Ganapathi Subramanian, Kyle Sprague, Colin Bellinger, Mark Crowley, Isaac Tamblyn
- Published: 28 Oct 2023, Last Modified: 04 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Latent Space Simulator for Unveiling Molecular Free Energy Landscapes and Predicting Transition Dynamics
Simon Dobers, Hannes Stark, Xiang Fu, Dominique Beaini, Stephan Günnemann
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Generation of 3D Realistic Soil Particles with Metaball Descriptor
Yifeng Zhao, Jinxin Liu, xiangbo gao, Pei Zhang, Stan Z. Li, Sergio Andres Galindo Torres
- Published: 28 Oct 2023, Last Modified: 08 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
AI Ethics Education for Scientists
Savannah Jennifer Thais
- Published: 28 Oct 2023, Last Modified: 16 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Scalable Particle Generation for Granular Shape Study
Yifeng Zhao, Jinxin Liu, Xiangbo Gao, Sergio Torres, Stan Z. Li
- Published: 28 Oct 2023, Last Modified: 08 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Gradient Estimation For Exactly-$k$ Constraints
Ruoyan Li, Dipti Ranjan Sahu, Guy Van den Broeck, Zhe Zeng
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
ExPT: Synthetic Pretraining for Few-Shot Experimental Design
Tung Nguyen, Sudhanshu Agrawal, Aditya Grover
- Published: 28 Oct 2023, Last Modified: 30 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Immunology Meets Artificial Intelligence: Expanding Our Scientific Toolbox
Van Truong, Matthew Lee, Dokyoon Kim, John Wherry, Marylyn Ritchie
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Insight Miner: A Time Series Analysis Dataset for Cross-Domain Alignment with Natural Language
Yunkai Zhang, Yawen Zhang, Ming Zheng, Kezhen Chen, Chongyang Gao, Ruian Ge, Siyuan Teng, Amine Jelloul, Jinmeng Rao, Xiaoyuan Guo, Chiang-Wei Fang, Zeyu Zheng, Jie Yang
- Published: 28 Oct 2023, Last Modified: 10 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Koopman-Assisted Reinforcement Learning
Preston Rozwood, Edward Mehrez, Ludger Paehler, Wen Sun, Steven Brunton
- Published: 28 Oct 2023, Last Modified: 10 Dec 2023
- NeurIPS2023-AI4Science Oral
- Readers: Everyone
Randomized Benchmarking of Local Zeroth-Order Optimizers for Variational Quantum Systems
Lucas Tecot, Cho-Jui Hsieh
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
STRIDE: Structure-guided Generation for Inverse Design of Molecules
Shehtab Zaman, Denis Akhiyarov, Mauricio Araya-Polo, Kenneth Chiu
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Towards out-of-distribution generalizable predictions of chemical kinetic properties
Zihao Wang, Yongqiang Chen, Yang Duan, Weijiang Li, Bo Han, James Cheng, Hanghang Tong
- Published: 28 Oct 2023, Last Modified: 04 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Predicting the Initial Conditions of the Universe using a Deterministic Neural Network
Vaibhav Jindal, Albert Liang, Aarti Singh, Shirley Ho, Drew Jamieson
- Published: 28 Oct 2023, Last Modified: 17 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
ChatPathway: Conversational Large Language Models for Biology Pathway Detection
Yanjing Li, Hannan Xu, Haiteng Zhao, Hongyu Guo, Shengchao Liu
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Learning Expert-Interpretable Programs for Myocardial Infarction Localization
Joshua Alan Flashner, Jennifer J. Sun, David Ouyang, Yisong Yue
- Published: 28 Oct 2023, Last Modified: 10 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Text2Decision: Decoding Latent Variables in Risky Decision Making from Think Aloud Text
Hanbo Xie, Huadong Xiong, Robert C. Wilson
- Published: 28 Oct 2023, Last Modified: 28 Oct 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Distilling human decision-making dynamics: a comparative analysis of low-dimensional architectures
Hua-Dong Xiong, Li Ji-An, Marcelo G Mattar, Robert C. Wilson
- Published: 28 Oct 2023, Last Modified: 09 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone
Representing Core-collapse Supernova Light Curves Analytically with Symbolic Regression
Kaylee de Soto, V. Ashley Villar
- Published: 28 Oct 2023, Last Modified: 10 Dec 2023
- NeurIPS2023-AI4Science Poster
- Readers: Everyone