14.7LGJan 20
Preconditioning Benefits of Spectral Orthogonalization in MuonJianhao Ma, Yu Huang, Yuejie Chi et al.
The Muon optimizer, a matrix-structured algorithm that leverages spectral orthogonalization of gradients, is a milestone in the pretraining of large language models. However, the underlying mechanisms of Muon -- particularly the role of gradient orthogonalization -- remain poorly understood, with very few works providing end-to-end analyses that rigorously explain its advantages in concrete applications. We take a step by studying the effectiveness of a simplified variant of Muon through two case studies: matrix factorization, and in-context learning of linear transformers. For both problems, we prove that simplified Muon converges linearly with iteration complexities independent of the relevant condition number, provably outperforming gradient descent and Adam. Our analysis reveals that the Muon dynamics decouple into a collection of independent scalar sequences in the spectral domain, each exhibiting similar convergence behavior. Our theory formalizes the preconditioning effect induced by spectral orthogonalization, offering insight into Muon's effectiveness in these matrix optimization problems and potentially beyond.
DrugImproverGPT: A Large Language Model for Drug Optimization with Fine-Tuning via Structured Policy OptimizationXuefeng Liu, Songhao Jiang, Siyu Chen et al.
Finetuning a Large Language Model (LLM) is crucial for generating results towards specific objectives. This research delves into the realm of drug optimization and introduce a novel reinforcement learning algorithm to finetune a drug optimization LLM-based generative model, enhancing the original drug across target objectives, while retains the beneficial chemical properties of the original drug. This work is comprised of two primary components: (1) DrugImprover: A framework tailored for improving robustness and efficiency in drug optimization. It includes a LLM designed for drug optimization and a novel Structured Policy Optimization (SPO) algorithm, which is theoretically grounded. This algorithm offers a unique perspective for fine-tuning the LLM-based generative model by aligning the improvement of the generated molecule with the input molecule under desired objectives. (2) A dataset of 1 million compounds, each with OEDOCK docking scores on 5 human proteins associated with cancer cells and 24 binding sites from SARS-CoV-2 virus. We conduct a comprehensive evaluation of SPO and demonstrate its effectiveness in improving the original drug across target properties. Our code and dataset will be publicly available at: https://github.com/xuefeng-cs/DrugImproverGPT.
3.3SPOct 30, 2024
SleepNetZero: Zero-Burden Zero-Shot Reliable Sleep Staging With Neural Networks Based on BallistocardiogramsShuzhen Li, Yuxin Chen, Xuesong Chen et al.
Sleep monitoring plays a crucial role in maintaining good health, with sleep staging serving as an essential metric in the monitoring process. Traditional methods, utilizing medical sensors like EEG and ECG, can be effective but often present challenges such as unnatural user experience, complex deployment, and high costs. Ballistocardiography~(BCG), a type of piezoelectric sensor signal, offers a non-invasive, user-friendly, and easily deployable alternative for long-term home monitoring. However, reliable BCG-based sleep staging is challenging due to the limited sleep monitoring data available for BCG. A restricted training dataset prevents the model from generalization across populations. Additionally, transferring to BCG faces difficulty ensuring model robustness when migrating from other data sources. To address these issues, we introduce SleepNetZero, a zero-shot learning based approach for sleep staging. To tackle the generalization challenge, we propose a series of BCG feature extraction methods that align BCG components with corresponding respiratory, cardiac, and movement channels in PSG. This allows models to be trained on large-scale PSG datasets that are diverse in population. For the migration challenge, we employ data augmentation techniques, significantly enhancing generalizability. We conducted extensive training and testing on large datasets~(12393 records from 9637 different subjects), achieving an accuracy of 0.803 and a Cohen's Kappa of 0.718. ZeroSleepNet was also deployed in real prototype~(monitoring pads) and tested in actual hospital settings~(265 users), demonstrating an accuracy of 0.697 and a Cohen's Kappa of 0.589. To the best of our knowledge, this work represents the first known reliable BCG-based sleep staging effort and marks a significant step towards in-home health monitoring.
2.3INS-DETJan 13
Towards a Self-Driving Trigger at the LHC: Adaptive Response in Real TimeShaghayegh Emami, Cecilia Tosciri, Giovanna Salvi et al.
Real-time data filtering and selection -- or trigger -- systems at high-throughput scientific facilities such as the experiments at the Large Hadron Collider (LHC) must process extremely high-rate data streams under stringent bandwidth, latency, and storage constraints. Yet these systems are typically designed as static, hand-tuned menus of selection criteria grounded in prior knowledge and simulation. In this work, we further explore the concept of a self-driving trigger, an autonomous data-filtering framework that reallocates resources and adjusts thresholds dynamically in real-time to optimize signal efficiency, rate stability, and computational cost as instrumentation and environmental conditions evolve. We introduce a benchmark ecosystem to emulate realistic collider scenarios and demonstrate real-time optimization of a menu including canonical energy sum triggers as well as modern anomaly-detection algorithms that target non-standard event topologies using machine learning. Using simulated data streams and publicly available collision data from the Compact Muon Solenoid (CMS) experiment, we demonstrate the capability to dynamically and automatically optimize trigger performance under specific cost objectives without manual retuning. Our adaptive strategy shifts trigger design from static menus with heuristic tuning to intelligent, automated, data-driven control, unlocking greater flexibility and discovery potential in future high-energy physics analyses.
5.7ROJun 24, 2024
MEReQ: Max-Ent Residual-Q Inverse RL for Sample-Efficient Alignment from InterventionYuxin Chen, Chen Tang, Jianglan Wei et al.
Aligning robot behavior with human preferences is crucial for deploying embodied AI agents in human-centered environments. A promising solution is interactive imitation learning from human intervention, where a human expert observes the policy's execution and provides interventions as feedback. However, existing methods often fail to utilize the prior policy efficiently to facilitate learning, thus hindering sample efficiency. In this work, we introduce MEReQ (Maximum-Entropy Residual-Q Inverse Reinforcement Learning), designed for sample-efficient alignment from human intervention. Instead of inferring the complete human behavior characteristics, MEReQ infers a residual reward function that captures the discrepancy between the human expert's and the prior policy's underlying reward functions. It then employs Residual Q-Learning (RQL) to align the policy with human preferences using this residual reward function. Extensive evaluations on simulated and real-world tasks demonstrate that MEReQ achieves sample-efficient policy alignment from human intervention.