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We present an active learning framework for efficiently generating training data for machine-learned interatomic potentials (MLIPs). The method combines local entropy-driven molecular dynamics with global dataset-aware filtering: a…

材料科学 · 物理学 2026-05-21 Meiyan Wang , Rishi Rao , Li Zhu

Data errors, corruptions, and poisoning attacks during training pose a major threat to the reliability of modern AI systems. While extensive effort has gone into empirical mitigations, the evolving nature of attacks and the complexity of…

机器学习 · 计算机科学 2025-10-28 Tobias Lorenz , Marta Kwiatkowska , Mario Fritz

Point processes offer a versatile framework for sequential event modeling. However, the computational challenges and constrained representational power of the existing point process models have impeded their potential for wider…

机器学习 · 统计学 2025-01-22 Zheng Dong , Zekai Fan , Shixiang Zhu

Timeseries regression models often struggle to leverage large volumes of labeled multimodal data, particularly when the data are irregularly sampled or contain missing values. This is common in domains like healthcare and predictive…

机器学习 · 计算机科学 2026-05-18 Antoine Honoré , Ming Xiao

Parameter-efficient fine-tuning (PEFT) techniques have emerged to address overfitting and high computational costs associated with fully fine-tuning in self-supervised learning. Mainstream PEFT methods add a few trainable parameters while…

计算机视觉与模式识别 · 计算机科学 2025-06-06 Xingliang Lei , Yiwen Ye , Zhisong Wang , Ziyang Chen , Minglei Shu , Weidong Cai , Yanning Zhang , Yong Xia

Multimodal semantic cues, such as textual descriptions, have shown strong potential in enhancing target perception for tracking. However, existing methods rely on static textual descriptions from large language models, which lack…

计算机视觉与模式识别 · 计算机科学 2025-10-16 Yukuan Zhang , Jiarui Zhao , Shangqing Nie , Jin Kuang , Shengsheng Wang

Multi-agent partially observable Markov decision processes (MPOMDPs) provide a framework to represent heterogeneous autonomous agents subject to uncertainty and partial observation. In this paper, given a nominal policy provided by a human…

系统与控制 · 电气工程与系统科学 2020-03-23 Mohamadreza Ahmadi , Andrew Singletary , Joel W. Burdick , Aaron D. Ames

In-context learning (ICL) is a few-shot learning paradigm that involves learning mappings through input-output pairs and appropriately applying them to new instances. Despite the remarkable ICL capabilities demonstrated by Large Language…

计算与语言 · 计算机科学 2024-08-06 Peng Wang , Xiaobin Wang , Chao Lou , Shengyu Mao , Pengjun Xie , Yong Jiang

We study the problem of conditional predictive inference on multiple outcomes missing at random (MAR) -- or equivalently, under covariate shift. While the weighted conformal prediction offers a tool for inference under covariate shift with…

统计方法学 · 统计学 2025-08-01 Yonghoon Lee , Edgar Dobriban , Eric Tchetgen Tchetgen

Instruction tuning (IT) achieves impressive zero-shot generalization results by training large language models (LLMs) on a massive amount of diverse tasks with instructions. However, how to select new tasks to improve the performance and…

计算与语言 · 计算机科学 2023-11-02 Po-Nien Kung , Fan Yin , Di Wu , Kai-Wei Chang , Nanyun Peng

Pro-inflammatory peptides (PIPs) play critical roles in immune signaling and inflammation but are difficult to identify experimentally due to costly and time-consuming assays. To address this challenge, we present KEMP-PIP, a hybrid machine…

定量方法 · 定量生物学 2026-02-25 Soumik Deb Niloy , Md. Fahmid-Ul-Alam Juboraj , Swakkhar Shatabda

In this paper, we consider a continuous-time Markov decision process (CTMDP) in Borel spaces, where the certainty equivalent with respect to the exponential utility of the total undiscounted cost is to be minimized. The cost rate is…

最优化与控制 · 数学 2016-11-29 Yi Zhang

The inferential models (IM) framework provides prior-free, frequency-calibrated, posterior probabilistic inference. The key is the use of random sets to predict unobservable auxiliary variables connected to the observable data and unknown…

统计理论 · 数学 2016-01-26 Ryan Martin , Chuanhai Liu

Multi-domain task-incremental learning requires a model to sequentially acquire knowledge across visually diverse domains without forgetting prior tasks, and without access to task identity at inference. Parameter-efficient methods built on…

计算机视觉与模式识别 · 计算机科学 2026-05-26 Sriram Mandalika

The thermal unit commitment (UC) problem has historically been formulated as a mixed integer quadratic programming (MIQP), which is difficult to solve efficiently, especially for large-scale systems. The tighter characteristic reduces the…

最优化与控制 · 数学 2022-09-26 Linfeng Yang , Shifei Chen , Zhaoyang Dong

The deployment of autonomous systems in safety-critical environments requires control policies that guarantee satisfaction of complex control specifications. These systems are commonly modeled as nonlinear discrete-time stochastic systems.…

系统与控制 · 电气工程与系统科学 2026-04-07 Alessandro Riccardi , Thom Badings , Luca Laurenti , Alessandro Abate , Bart De Schutter

Large Multimodal Models (LMMs) exhibit remarkable multi-tasking ability by learning mixed instruction datasets. However, novel tasks would be encountered sequentially in dynamic world, which urges for equipping LMMs with multimodal…

计算机视觉与模式识别 · 计算机科学 2025-08-26 Fanhu Zeng , Fei Zhu , Haiyang Guo , Xu-Yao Zhang , Cheng-Lin Liu

Prompt learning has become the most effective paradigm for adapting large pre-trained vision-language models (VLMs) to downstream tasks. Recently, unsupervised prompt tuning methods, such as UPL and POUF, directly leverage pseudo-labels as…

计算机视觉与模式识别 · 计算机科学 2024-04-26 Sifan Long , Linbin Wang , Zhen Zhao , Zichang Tan , Yiming Wu , Shengsheng Wang , Jingdong Wang

Many event sequence data exhibit mutually exciting or inhibiting patterns. Reliable detection of such temporal dependency is crucial for scientific investigation. The de facto model is the Multivariate Hawkes Process (MHP), whose impact…

应用统计 · 统计学 2023-05-31 Yu Chen , Fengpei Li , Anderson Schneider , Yuriy Nevmyvaka , Asohan Amarasingham , Henry Lam

In this paper, we consider a class of inhomogeneous semi-Markov processes directly based on intensity processes for marked point processes. We show that this class satisfies the semi-Markov properties defined elsewhere in the literature. We…

概率论 · 数学 2015-04-14 Alexander Sokol
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