activity
20222024
most citedMay the Force be with You: Unified Force-Centric Pre-Training for 3D Molecular Conformations

4 citations · 11 across the 7 of their papers we have counts for

collaborators

7 papers

cs.RO2024

Case Study: Runtime Safety Verification of Neural Network Controlled System

Frank Yang, Sinong Simon Zhan, Yixuan Wang +2

Neural networks are increasingly used in safety-critical applications such as robotics and autonomous vehicles. However, the deployment of neural-network-controlled systems (NNCSs)…

cs.LG20243 cited

Towards a Digital Twin Framework in Additive Manufacturing: Machine Learning and Bayesian Optimization for Time Series Process Optimization

Vispi Karkaria, Anthony Goeckner, Rujing Zha +6

Laser-directed-energy deposition (DED) offers advantages in additive manufacturing (AM) for creating intricate geometries and material grading. Yet, challenges like material incons…

cs.LG20233 cited

PolyGET: Accelerating Polymer Simulations by Accurate and Generalizable Forcefield with Equivariant Transformer

Rui Feng, Huan Tran, Aubrey Toland +4

Polymer simulation with both accuracy and efficiency is a challenging task. Machine learning (ML) forcefields have been developed to achieve both the accuracy of ab initio methods…

physics.chem-ph20234 cited

May the Force be with You: Unified Force-Centric Pre-Training for 3D Molecular Conformations

Rui Feng, Qi Zhu, Huan Tran +4

Recent works have shown the promise of learning pre-trained models for 3D molecular representation. However, existing pre-training models focus predominantly on equilibrium data an…

cs.CL20231 cited

Patton: Language Model Pretraining on Text-Rich Networks

Bowen Jin, Wentao Zhang, Yu Zhang +4

A real-world text corpus sometimes comprises not only text documents but also semantic links between them (e.g., academic papers in a bibliographic network are linked by citations…

cs.LG2023

Learning Representation for Anomaly Detection of Vehicle Trajectories

Ruochen Jiao, Juyang Bai, Xiangguo Liu +4

Predicting the future trajectories of surrounding vehicles based on their history trajectories is a critical task in autonomous driving. However, when small crafted perturbations a…