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Hao Zhou

156 accepted papers

2026

Beyond Euclidean Clipping: Overcoming Exploration Collapse in LLM RL via Riemannian Isometric Policy Optimization

ICML 2026poster

Reinforcement learning (RL) has become a dominant paradigm for enhancing LLMs' reasoning capabilities. However, RL algorithms with PPO-Clip are inherently limited by exploration collapse. Subsequent works remain primarily heuristic and fail to identify the essential cause of PPO-Clip’s failure. This…

Cited by 0SourceScholar
2026

Conan: Progressive Learning to Reason Like a Detective over Multi-Scale Visual Evidence

CVPR 2026

Video reasoning, which requires multi-step deduction across frames, remains a major challenge for multimodal large language models (MLLMs). While reinforcement learning (RL)-based methods enhance reasoning capabilities, they often rely on text-only chains that yield ungrounded or hallucinated conclu

Cited by 0SourcecodeScholar
2026

CubeBench: Diagnosing Interactive, Long-Horizon Physical Intelligence under Partial Observations

ICLR 2026poster

Large Language Model (LLM) agents, while proficient in the digital realm, face a significant gap in physical-world deployment due to the challenge of forming and maintaining a robust spatial mental model. We identify three core cognitive challenges hindering this transition: spatial reasoning, long-…

Cited by 0SourcecodeScholar
2026

DCFold: Efficient Protein Structure Generation with Single Forward Pass

ICLR 2026oral

AlphaFold3 introduces a diffusion-based architecture that elevates protein structure prediction to all-atom resolution with improved accuracy. This state-of-the-art performance has established AlphaFold3 as a foundation model for diverse generation and design tasks. However, its iterative design sub…

Cited by 0SourceScholar
2026

Demystifying Multimodal Biomolecular Co-design With Intrinsic Geodesic Coupling

ICML 2026poster

Biomolecules such as proteins and small-molecule ligands play a central role in biological systems, arising from the tight interplay between sequence and three-dimensional structure. Recent generative models for biomolecular co-design aim to capture this interplay by jointly modeling coupled modalit…

Cited by 0SourceScholar
2026

Generalizing Linear Autoencoder Recommenders with Decoupled Expected Quadratic Loss

ICLR 2026poster

Linear autoencoders (LAEs) have gained increasing popularity in recommender systems due to their simplicity and strong empirical performance. Most LAE models, including the Emphasized Denoising Linear Autoencoder (EDLAE) introduced by (Steck, 2020), use quadratic loss during training. However, the o…

Cited by 0SourceScholar
2026

HiMAE: Hierarchical Masked Autoencoders Discover Resolution-Specific Structure in Wearable Time Series

ICLR 2026poster

Wearable sensors provide abundant physiological time series observations, yet the resolution at which we should extract features for downstream tasks remain unclear. We hypothesize that temporal resolution is a fundamental axis of representation learning, with different clinical and behavioral outco…

Cited by 0SourcecodeScholar
2026

MACS: Multi-source Audio-to-image Generation with Contextual Significance and Semantic Alignment

AAAI 2026technical

Propelled by the breakthrough in deep generative models, audio-to-image generation has emerged as a pivotal cross-modal task that converts complex auditory signals into rich visual representations. However, previous works only focus on single-source audio inputs for image generation, ignoring the mu

Cited by 0SourcePDFScholar
2026

MemAgent: Reshaping Long-Context LLM with Multi-Conv RL-based Memory Agent

ICLR 2026oral

Despite improvements by length extrapolation, efficient attention and memory modules, handling infinitely long documents without performance degradation during extrapolation remains the ultimate challenge in long-text processing. To solve this problem, We introduce a novel agent workflow, \method, w…

Cited by 0SourceScholar
2026

MoMa: A Simple Modular Learning Framework for Material Property Prediction

ICLR 2026poster

Deep learning methods for material property prediction have been widely explored to advance materials discovery. However, the prevailing pre-train paradigm often fails to address the inherent diversity and disparity of material tasks. To overcome these challenges, we introduce MoMa, a simple Modular…

Cited by 0SourceScholar
2026

NaviAgent: Graph‑Driven Bilevel Planning for Scalable Tool Orchestration

ICML 2026poster

Large Language Models (LLMs) increasingly act as function call agents that invoke external tools to tackle tasks beyond their static knowledge. However, they typically invoke tools one at a time without a global view of task structure. As tools often depend on one another, this leads to error accumu…

Cited by 0SourceScholar
2026

PerFlow: Physics-Embedded Rectified Flow for Efficient Reconstruction and Uncertainty Quantification of Spatiotemporal Dynamics

IJCAI 2026

Reconstructing PDE-governed fields from sparse and irregular measurements is challenging due to their ill-posed nature. Deterministic surrogates are trained on dense fields that struggle with limited measurements and uncertainty quantification. Generative models, by learning distributions over spati

Cited by 0Scholar
2026

Physiology-Aware Masked Cross-Modal Reconstruction for Biosignal Representation Learning

ICML 2026poster

Biosignals acquired from different locations on the body often provide temporally ordered views of the same underlying physiological process. However, most existing self-supervised learning methods treat these signals as interchangeable views, overlooking the directional temporal dynamics that link …

Cited by 0SourceScholar
2026

ReaForest: Fostering Generative Video Reasoning for Spatial Planning

ICML 2026poster

Verbal logic and visual mental simulation are two essential components of human intelligence. Modern Large Language Models (LLMs) have demonstrated strong verbal reasoning capabilities through textual Chain-of-Thought (CoT) reasoning. In contrast, current Video Generation Models (VGMs) struggle with…

Cited by 0SourceScholar
2026

Recover to Predict: Progressive Retrospective Learning for Variable-Length Trajectory Prediction

CVPR 2026

Trajectory prediction is critical for autonomous driving, enabling safe and efficient planning in dense, dynamic traffic. Most existing methods optimize prediction accuracy under fixed-length observations. However, real-world driving often yields variable-length, incomplete observations, posing a ch

Cited by 0SourcecodeScholar
2026

Safety Anchor: Defending Harmful Fine-tuning via Geometric Bottlenecks

ICML 2026poster

The safety alignment of Large Language Models (LLMs) remains vulnerable to Harmful Fine-tuning (HFT). While existing defenses impose constraints on parameters, gradients, or internal representations, we observe that they can be effectively circumvented under persistent HFT. Our analysis traces this …

Cited by 0SourceScholar
2026

Similarity-Consistent Likelihood Diffusion enables Hidden Person Detection from Wall Reflections

CVPR 2026

Non-line-of-sight (NLOS) imaging seeks to recover hidden-scene information from indirect light transport beyond the direct line of sight. Existing NLOS methods can be broadly categorized into active and passive approaches. Active methods rely on controlled illumination and time-resolved sensors, but

Cited by 0SourceScholar
2025

A Periodic Bayesian Flow for Material Generation

ICLR 2025spotlight

Generative modeling of crystal data distribution is an important yet challenging task due to the unique periodic physical symmetry of crystals. Diffusion-based methods have shown early promise in modeling crystal distribution. More recently, Bayesian Flow Networks were introduced to aggregate noisy…

2025

APB: Accelerating Distributed Long-Context Inference by Passing Compressed Context Blocks across GPUs

ACL 2025long

While long-context inference is crucial for advancing large language model (LLM) applications, its prefill speed remains a significant bottleneck. Current approaches, including sequence parallelism strategies and compute reduction through approximate attention mechanisms, still fall short of deliver…

2025

Accelerating 3D Molecule Generative Models with Trajectory Diagnosis

NeurIPS 2025poster

Geometric molecule generative models have found expanding applications across various scientific domains, but their generation inefficiency has become a critical bottleneck. Through a systematic investigation of the generative trajectory, we discover a unique challenge for molecule geometric graph g…

Cited by 0SourceScholar
2025

Bi-Level Decision-Focused Causal Learning for Large-Scale Marketing Optimization: Bridging Observational and Experimental Data

NeurIPS 2025poster

Online Internet platforms require sophisticated marketing strategies to optimize user retention and platform revenue — a classical resource allocation problem. Traditional solutions adopt a two-stage pipeline: machine learning (ML) for predicting individual treatment effects to marketing actions, fo…

Cited by 0SourceScholar
2025

CO2-Net: A Physics-Informed Spatio-Temporal Model for Global Surface CO2 Reconstruction

ICCV 2025poster

Reconstructing atmospheric surface \text CO _2 is crucial for understanding climate dynamics and informing global mitigation strategies. Traditional inversion models achieve precise global \text CO _2 reconstruction but rely heavily on uncertain prior estimates of fluxes and emissions. Inspired by r…

2025

Change3D: Revisiting Change Detection and Captioning from A Video Modeling Perspective

CVPR 2025highlight

In this paper, we present Change3D, a framework that reconceptualizes the change detection and captioning tasks through video modeling. Recent methods have achieved remarkable success by regarding each pair of bi-temporal images as separate frames. They employ a shared-weight image encoder to extrac…

2025

Computationally and Sample Efficient Safe Reinforcement Learning Using Adaptive Conformal Prediction

ICRA 2025

Safety is a critical concern in learning-enabled autonomous systems especially when deploying these systems in real-world scenarios. An important challenge is accurately quantifying the uncertainty of unknown models to generate provably safe control policies that facilitate the gathering of informat

Cited by 4SourceScholar
2025

DAPO: An Open-Source LLM Reinforcement Learning System at Scale

NeurIPS 2025poster

Inference scaling empowers LLMs with unprecedented reasoning ability, with reinforcement learning as the core technique to elicit complex reasoning. However, key technical details of state-of-the-art reasoning LLMs are concealed (such as in OpenAI o1 blog and DeepSeek R1 technical report), thus the…

Cited by 0SourceScholar
2025

Empower Structure-Based Molecule Optimization with Gradient Guided Bayesian Flow Networks

ICML 2025poster

Structure-based molecule optimization (SBMO) aims to optimize molecules with both continuous coordinates and discrete types against protein targets. A promising direction is to exert gradient guidance on generative models given its remarkable success in images, but it is challenging to guide discret…

2025

Enigmata: Scaling Logical Reasoning in Large Language Models with Synthetic Verifiable Puzzles

NeurIPS 2025spotlight

Large Language Models (LLMs), such as OpenAI’s o1 and DeepSeek’s R1, excel at advanced reasoning tasks like math and coding via Reinforcement Learning with Verifiable Rewards (RLVR), but still struggle with puzzles solvable by humans without domain knowledge. We introduce ENIGMATA, the first compreh…

Cited by 0SourcecodeScholar
2025

FR-Spec: Accelerating Large-Vocabulary Language Models via Frequency-Ranked Speculative Sampling

ACL 2025long

Speculative sampling has emerged as an important technique for accelerating the auto-regressive generation process of large language models (LLMs) by utilizing a draft-then-verify mechanism to produce multiple tokens per forward pass. While state-of-the-art speculative sampling methods use only a si…

2025

Generative AI for Immersive Video: Recent Advances and Future Opportunities

IJCAI 2025

Immersive video serves as a key component of eXtended Reality (XR) that aims to create and interact with simulated virtual or hybrid environments. Such a technology allows users to experience immersive sensations that transcend time and space, and meanwhile continuously providing training data for e

Cited by 0SourcePDFScholar
2025

HRScene: How Far Are VLMs from Effective High-Resolution Image Understanding?

ICCV 2025poster

High-resolution image (HRI) understanding aims to process images with a large number of pixels, such as pathological images and agricultural aerial images, both of which can exceed 1 million pixels. Vision Large Language Models (VLMs) can allegedly handle HRIs, however, there is a lack of a comprehe…

Cited by 0SourcePDFScholar
2025

Hints of Prompt: Enhancing Visual Representation for Multimodal LLMs in Autonomous Driving

ICCV 2025poster

In light of the dynamic nature of autonomous driving environments and stringent safety requirements, general MLLMs combined with CLIP alone often struggle to accurately represent driving-specific scenarios, particularly in complex interactions and long-tail cases. To address this, we propose the Hin…

Cited by 0SourcePDFScholar
2025

Investigating and Scaling up Code-Switching for Multilingual Language Model Pre-Training

ACL 2025finding

Large language models (LLMs) exhibit remarkable multilingual capabilities despite the extreme language imbalance in the pre-training data. In this paper, we closely examine the reasons behind this phenomenon, focusing on the pre-training corpus. We find that the existence of code-switching, alternat…

2025

Know Your Heart Better: Multimodal Cardiac Output Monitoring using Earbuds

ICASSP 2025accepted

Cardiac Output (CO) is a critical indicator of health, offering insights into cardiac dysfunction, acute stress responses, and cognitive decline. Traditional CO monitoring methods, like impedance cardiography, are invasive and impractical for daily use, leading to a gap in continuous, non-invasive m…

Cited by 0SourceScholar
2025

La RoSA: Enhancing LLM Efficiency via Layerwise Rotated Sparse Activation

ICML 2025poster

Activation sparsity can reduce the computational overhead and memory transfers during the forward pass of Large Language Model (LLM) inference. Existing methods face limitations, either demanding time-consuming recovery training that hinders real-world adoption, or relying on empirical magnitude-bas…

Cited by 0SourcePDFScholar
2025

MOF-BFN: Metal-Organic Frameworks Structure Prediction via Bayesian Flow Networks

NeurIPS 2025poster

Metal-Organic Frameworks (MOFs) have attracted considerable attention due to their unique properties including high surface area and tunable porosity, and promising applications in catalysis, gas storage, and drug delivery. Structure prediction for MOFs is a challenging task, as these frameworks are…

Cited by 0SourceScholar
2025

MiniPLM: Knowledge Distillation for Pre-training Language Models

ICLR 2025poster

Knowledge distillation (KD) is widely used to train small, high-performing student language models (LMs) using large teacher LMs. While effective in fine-tuning, KD during pre-training faces efficiency, flexibility, and effectiveness issues. Existing methods either incur high computational costs d…

2025

MoE-LPR: Multilingual Extension of Large Language Models Through Mixture-of-Experts with Language Priors Routing

AAAI 2025technical

Large Language Models (LLMs) are often English-centric due to the disproportionate distribution of languages in their pre-training data. Enhancing non-English language capabilities through post-pretraining often results in catastrophic forgetting of high-resource languages. Previous methods either a…

2025

MobA: Multifaceted Memory-Enhanced Adaptive Planning for Efficient Mobile Task Automation

NAACL 2025system demonstrations

Existing Multimodal Large Language Model (MLLM)-based agents face significant challenges in handling complex GUI (Graphical User Interface) interactions on devices. These challenges arise from the dynamic and structured nature of GUI environments, which integrate text, images, and spatial relationsh…

2025

Optimizing Biomarkers from Earbud Ballistocardiogram: Calibration and Calibration-Free Algorithms for Accelerometer Axis Selection and Fusion

ICASSP 2025accepted

The earbud-based ballistocardiogram (BCG) assessment holds significant promise for monitoring diverse physiological signals, including stress, cardiac activity, and blood pressure. However, unlike traditional methods that measure the force component along the head-to-foot axis for enhanced BCG signa…

Cited by 0SourceScholar
2025

Piloting Structure-Based Drug Design via Modality-Specific Optimal Schedule

ICML 2025poster

Structure-Based Drug Design (SBDD) is crucial for identifying bioactive molecules. Recent deep generative models are faced with challenges in geometric structure modeling. A major bottleneck lies in the twisted probability path of multi-modalities—continuous 3D positions and discrete 2D topologies—w…

2025

PunchBench: Benchmarking MLLMs in Multimodal Punchline Comprehension

ACL 2025long

Multimodal punchlines, which involve humor or sarcasm conveyed in image-caption pairs, are a popular way of communication on online multimedia platforms. With the rapid development of multimodal large language models (MLLMs), it is essential to assess their ability to effectively comprehend these pu…

Cited by 0SourcePDFScholar
2025

Rationalized All-Atom Protein Design with Unified Multi-Modal Bayesian Flow

NeurIPS 2025poster

Designing functional proteins is a critical yet challenging problem due to the intricate interplay between backbone structures, sequences, and side-chains. Current approaches often decompose protein design into separate tasks, which can lead to accumulated errors, while recent efforts increasingly f…

Cited by 0SourceScholar
2025

Reducing Confounding Bias without Data Splitting for Causal Inference via Optimal Transport

ICML 2025poster

Causal inference seeks to estimate the effect given a treatment such as a medicine or the dosage of a medication. To reduce the confounding bias caused by the non-randomized treatment assignment, most existing methods reduce the shift between subpopulations receiving different treatments. However, t…

Cited by 0SourcePDFScholar
2025

Retrieval is Not Enough: Enhancing RAG through Test-Time Critique and Optimization

NeurIPS 2025poster

Retrieval-augmented generation (RAG) has become a widely adopted paradigm for enabling knowledge-grounded large language models (LLMs). However, standard RAG pipelines often fail to ensure that model reasoning remains consistent with the evidence retrieved, leading to factual inconsistencies or unsu…

Cited by 0SourcecodeScholar
2025

Retro-R1: LLM-based Agentic Retrosynthesis

NeurIPS 2025poster

Retrosynthetic planning is a fundamental task in chemical discovery. Due to the vast combinatorial search space, identifying viable synthetic routes remains a significant challenge--even for expert chemists. Recent advances in Large Language Models (LLMs), particularly equipped with reinforcement le…

Cited by 0SourceScholar
2025

RetroDiff: Retrosynthesis as Multi-stage Distribution Interpolation

AISTATS 2025poster

Retrosynthesis poses a key challenge in biopharmaceuticals, aiding chemists in finding appropriate reactant molecules for given product molecules. With reactants and products represented as 2D graphs, retrosynthesis constitutes a conditional graph-to-graph (G2G) generative task. Inspired by advancem…

Cited by 0SourceScholar
2025

SToFM: a Multi-scale Foundation Model for Spatial Transcriptomics

ICML 2025poster

Spatial Transcriptomics (ST) technologies provide biologists with rich insights into single-cell biology by preserving spatial context of cells. Building foundational models for ST can significantly enhance the analysis of vast and complex data sources, unlocking new perspectives on the intricacies…

Cited by 0SourcePDFScholar
2025

ShortListing Model: A Streamlined Simplex Diffusion for Discrete Variable Generation

NeurIPS 2025poster

Generative modeling of discrete variables is challenging yet crucial for applications in natural language processing and biological sequence design. We introduce the Shortlisting Model (SLM), a novel simplex-based diffusion model inspired by progressive candidate pruning. SLM operates on simplex cen…

Cited by 0SourcecodeScholar
2025

Smooth Interpolation for Improved Discrete Graph Generative Models

ICML 2025poster

Though typically represented by the discrete node and edge attributes, the graph topological information can be sufficiently captured by the graph spectrum in a continuous space. It is believed that incorporating the continuity of graph topological information into the generative process design coul…

Cited by 0SourcePDFScholar
2025

Steering Protein Family Design through Profile Bayesian Flow

ICLR 2025oral

Protein family design emerges as a promising alternative by combining the advantages of de novo protein design and mutation-based directed evolution.In this paper, we propose ProfileBFN, the Profile Bayesian Flow Networks, for specifically generative modeling of protein families. ProfileBFN extends…

Cited by 0SourcePDFScholar
2025

Three-Dimensional Trajectory Prediction with 3DMoTraj Dataset

ICML 2025poster

With the growing interest in embodied and spatial intelligence, accurately predicting trajectories in 3D environments has become increasingly critical. However, no datasets have been explicitly designed to study 3D trajectory prediction. To this end, we contribute a 3D motion trajectory (3DMoTraj) d…

2025

Vision-Language Models Can Self-Improve Reasoning via Reflection

NAACL 2025long

Chain-of-thought (CoT) has proven to improve the reasoning capability of large language models (LLMs). However, due to the complexity of multimodal scenarios and the difficulty in collecting high-quality CoT data, CoT reasoning in multimodal LLMs has been largely overlooked. To this end, we propose…

2024

A Decoding Algorithm for Length-Control Summarization Based on Directed Acyclic Transformers

EMNLP 2024finding

Length-control summarization aims to condense long texts into a short one within a certain length limit. Previous approaches often use autoregressive (AR) models and treat the length requirement as a soft constraint, which may not always be satisfied. In this study, we propose a novel length-control…

2024

A Strategic Analysis of Prepayments in Financial Credit Networks

IJCAI 2024poster

In financial credit networks, prepayments enable a firm to settle its debt obligations ahead of an agreed-upon due date. Prepayments have a transformative impact on the structure of networks, influencing the financial well-being (utility) of individual firms. This study investigates prepayments from…

Cited by 5SourcePDFScholar
2024

AnyFit: Controllable Virtual Try-on for Any Combination of Attire Across Any Scenario

NeurIPS 2024poster

While image-based virtual try-on has made significant strides, emerging approaches still fall short of delivering high-fidelity and robust fitting images across various scenarios, as their models suffer from issues of ill-fitted garment styles and quality degrading during the training process, not t…

Cited by 7SourcePDFScholar
2024

Collage: Light-Weight Low-Precision Strategy for LLM Training

ICML 2024poster

Large models training is plagued by the intense compute cost and limited hardware memory. A practical solution is low-precision representation but is troubled by loss in numerical accuracy and unstable training rendering the model less useful. We argue that low-precision floating points can perform…

2024

Communication-Oriented Automatic Assessment System for Accented Spoken Chinese in Read-Aloud Tasks

ICASSP 2024accepted

The development of speech signal processing and deep learning has brought in many intelligent language learning tools. However, non-native Chinese learners (second-language or L2 learners) are often discouraged by language assessment applications on the market because of their accent. By contrast to…

Cited by 0SourceScholar
2024

Diffusion Glancing Transformer for Parallel Sequence-to-Sequence Learning

NAACL 2024long

Previously, non-autoregressive models were widely recognized as being superior in generation efficiency but inferior in generation quality due to the challenges of modeling multiple target modalities.To enhance the multi-modality modeling ability, we propose the diffusion glancing transformer, which…

Cited by 3SourcePDFScholar
2024

ESM All-Atom: Multi-Scale Protein Language Model for Unified Molecular Modeling

ICML 2024poster

Protein language models have demonstrated significant potential in the field of protein engineering. However, current protein language models primarily operate at the residue scale, which limits their ability to provide information at the atom level. This limitation prevents us from fully exploiting…

2024

Enhancing Byzantine-Resistant Aggregations with Client Embedding

EMNLP 2024finding

Byzantine-resistant aggregations detect poisonous clients and discard them to ensure that the global model is not poisoned or attacked by malicious clients. However, these aggregations are mainly conducted on the parameter space, and the parameter distances cannot reflect the data distribution diver…

Cited by 0SourcePDFScholar
2024

Exploring Conditional Variational Mechanism to Pinyin Input Method for Addressing One-to-Many Mappings in Low-Resource Scenarios

ACL 2024short

Pinyin input method engine (IME) refers to the transformation tool from pinyin sequence to Chinese characters, which is widely used on mobile phone applications. Due to the homophones, Pinyin IME suffers from the one-to-many mapping problem in the process of pinyin sequences to Chinese characters. T…

2024

FROSTER: Frozen CLIP is A Strong Teacher for Open-Vocabulary Action Recognition

ICLR 2024poster

In this paper, we introduce \textbf{FROSTER}, an effective framework for open-vocabulary action recognition. The CLIP model has achieved remarkable success in a range of image-based tasks, benefiting from its strong generalization capability stemming from pretaining on massive image-text pairs. Howe…

2024

Intentional Evolutionary Learning for Untrimmed Videos with Long Tail Distribution

AAAI 2024technical

Human intention understanding in untrimmed videos aims to watch a natural video and predict what the person’s intention is. Currently, exploration of predicting human intentions in untrimmed videos is far from enough. On the one hand, untrimmed videos with mixed actions and backgrounds have a signif…

2024

Large Language Models Are Not Robust Multiple Choice Selectors

ICLR 2024spotlight

Multiple choice questions (MCQs) serve as a common yet important task format in the evaluation of large language models (LLMs). This work shows that modern LLMs are vulnerable to option position changes in MCQs due to their inherent “selection bias”, namely, they prefer to select specific option IDs…

2024

Mol-AE: Auto-Encoder Based Molecular Representation Learning With 3D Cloze Test Objective

ICML 2024poster

3D molecular representation learning has gained tremendous interest and achieved promising performance in various downstream tasks. A series of recent approaches follow a prevalent framework: an encoder-only model coupled with a coordinate denoising objective. However, through a series of analytical…

Cited by 7SourcePDFScholar
2024

MolCRAFT: Structure-Based Drug Design in Continuous Parameter Space

ICML 2024poster

Generative models for structure-based drug design (SBDD) have shown promising results in recent years. Existing works mainly focus on how to generate molecules with higher binding affinity, ignoring the feasibility prerequisites for generated 3D poses and resulting in *false positives*. We conduct t…

2024

Multimodal Molecular Pretraining via Modality Blending

ICLR 2024poster

Self-supervised learning has recently gained growing interest in molecular modeling for scientific tasks such as AI-assisted drug discovery. Current studies consider leveraging both 2D and 3D molecular structures for representation learning. However, relying on straightforward alignment strategies t…

Cited by 18SourcePDFScholar
2024

MutaPLM: Protein Language Modeling for Mutation Explanation and Engineering

NeurIPS 2024poster

Studying protein mutations within amino acid sequences holds tremendous significance in life sciences. Protein language models (PLMs) have demonstrated strong capabilities in broad biological applications. However, due to architectural design and lack of supervision, PLMs model mutations implicitly…

2024

On Prompt-Driven Safeguarding for Large Language Models

ICML 2024poster

Prepending model inputs with safety prompts is a common practice for safeguarding large language models (LLMs) against queries with harmful intents. However, the underlying working mechanisms of safety prompts have not been unraveled yet, restricting the possibility of automatically optimizing them…

2024

Open-Vocabulary 3D Semantic Segmentation with Text-to-Image Diffusion Models

ECCV 2024poster

"In this paper, we investigate the use of diffusion models which are pre-trained on large-scale image-caption pairs for open-vocabulary 3D semantic understanding. We propose a novel method, namely Diff2Scene, which leverages frozen representations from text-image generative models, along with salien…

Cited by 4SourcePDFScholar
2024

P$^2$C$^2$Net: PDE-Preserved Coarse Correction Network for efficient prediction of spatiotemporal dynamics

NeurIPS 2024poster

When solving partial differential equations (PDEs), classical numerical methods often require fine mesh grids and small time stepping to meet stability, consistency, and convergence conditions, leading to high computational cost. Recently, machine learning has been increasingly utilized to solve PDE…

Cited by 5SourcePDFScholar
2024

Reducing Balancing Error for Causal Inference via Optimal Transport

ICML 2024poster

Most studies on causal inference tackle the issue of confounding bias by reducing the distribution shift between the control and treated groups. However, it remains an open question to adopt an appropriate metric for distribution shift in practice. In this paper, we define a generic balancing error…

Cited by 3SourcePDFScholar
2024

Revisiting the Domain Shift and Sample Uncertainty in Multi-source Active Domain Transfer

CVPR 2024poster

Active Domain Adaptation (ADA) aims to maximally boost model adaptation in a new target domain by actively selecting a limited number of target data to annotate. This setting neglects the more practical scenario where training data are collected from multiple sources. This motivates us to extend ADA…

Cited by 20SourcePDFScholar
2024

Towards Codable Watermarking for Injecting Multi-Bits Information to LLMs

ICLR 2024poster

As large language models (LLMs) generate texts with increasing fluency and realism, there is a growing need to identify the source of texts to prevent the abuse of LLMs. Text watermarking techniques have proven reliable in distinguishing whether a text is generated by LLMs by injecting hidden patter…

2024

Unified Generative Modeling of 3D Molecules with Bayesian Flow Networks

ICLR 2024oral

Advanced generative model (\textit{e.g.}, diffusion model) derived from simplified continuity assumptions of data distribution, though showing promising progress, has been difficult to apply directly to geometry generation applications due to the \textit{multi-modality} and \textit{noise-sensitive}…

Cited by 26SourcePDFScholar
2024

Variance-reduced Zeroth-Order Methods for Fine-Tuning Language Models

ICML 2024poster

Fine-tuning language models (LMs) has demonstrated success in a wide array of downstream tasks. However, as LMs are scaled up, the memory requirements for backpropagation become prohibitively high. Zeroth-order (ZO) optimization methods can leverage memory-efficient forward passes to estimate gradie…

Cited by 20SourcePDFScholar
2024

VideoPrism: A Foundational Visual Encoder for Video Understanding

ICML 2024poster

We introduce VideoPrism, a general-purpose video encoder that tackles diverse video understanding tasks with a single frozen model. We pretrain VideoPrism on a heterogeneous corpus containing 36M high-quality video-caption pairs and 582M video clips with noisy parallel text (e.g., ASR transcripts).…

Cited by 109SourcePDFScholar
2023

Coarse-to-Fine: a Hierarchical Diffusion Model for Molecule Generation in 3D

ICML 2023poster

Generating desirable molecular structures in 3D is a fundamental problem for drug discovery. Despite the considerable progress we have achieved, existing methods usually generate molecules in atom resolution and ignore intrinsic local structures such as rings, which leads to poor quality in generate…

2023

Connective Prediction for Implicit Discourse Relation Recognition via Knowledge Distillation

ACL 2023long

Implicit discourse relation recognition (IDRR) remains a challenging task in discourse analysis due to the absence of connectives. Most existing methods utilize one-hot labels as the sole optimization target, ignoring the internal association among connectives. Besides, these approaches spend lots o…

Cited by 13SourcePDFScholar
2023

Diffusion Theory as a Scalpel: Detecting and Purifying Poisonous Dimensions in Pre-trained Language Models Caused by Backdoor or Bias

ACL 2023findings

Pre-trained Language Models (PLMs) may be poisonous with backdoors or bias injected by the suspicious attacker during the fine-tuning process. A core challenge of purifying potentially poisonous PLMs is precisely finding poisonous dimensions. To settle this issue, we propose the Fine-purifying appro…

Cited by 7SourcePDFScholar
2023

Direct Heterogeneous Causal Learning for Resource Allocation Problems in Marketing

AAAI 2023technical

Marketing is an important mechanism to increase user engagement and improve platform revenue, and heterogeneous causal learning can help develop more effective strategies. Most decision-making problems in marketing can be formulated as resource allocation problems and have been studied for decades.…

2023

Equivariant Flow Matching with Hybrid Probability Transport for 3D Molecule Generation

NeurIPS 2023poster

The generation of 3D molecules requires simultaneously deciding the categorical features (atom types) and continuous features (atom coordinates). Deep generative models, especially Diffusion Models (DMs), have demonstrated effectiveness in generating feature-rich geometries. However, existing DMs ty…

2023

Fed-FA: Theoretically Modeling Client Data Divergence for Federated Language Backdoor Defense

NeurIPS 2023poster

Federated learning algorithms enable neural network models to be trained across multiple decentralized edge devices without sharing private data. However, they are susceptible to backdoor attacks launched by malicious clients. Existing robust federated aggregation algorithms heuristically detect and…

Cited by 4SourcePDFScholar
2023

Graph Contrastive Learning for Skeleton-based Action Recognition

ICLR 2023poster

In the field of skeleton-based action recognition, current top-performing graph convolutional networks (GCNs) exploit intra-sequence context to construct adaptive graphs for feature aggregation. However, we argue that such context is still $\textit{local}$ since the rich cross-sequence relations hav…

2023

HAP: Structure-Aware Masked Image Modeling for Human-Centric Perception

NeurIPS 2023poster

Model pre-training is essential in human-centric perception. In this paper, we first introduce masked image modeling (MIM) as a pre-training approach for this task. Upon revisiting the MIM training strategy, we reveal that human structure priors offer significant potential. Motivated by this insight…

2023

Label Words are Anchors: An Information Flow Perspective for Understanding In-Context Learning

EMNLP 2023long main

In-context learning (ICL) emerges as a promising capability of large language models (LLMs) by providing them with demonstration examples to perform diverse tasks. However, the underlying mechanism of how LLMs learn from the provided context remains under-explored. In this paper, we investigate the…

Cited by 0SourcecodeScholar
2023

Learning Harmonic Molecular Representations on Riemannian Manifold

ICLR 2023poster

Molecular representation learning plays a crucial role in AI-assisted drug discovery research. Encoding 3D molecular structures through Euclidean neural networks has become the prevailing method in the geometric deep learning community. However, the equivariance constraints and message passing in Eu…

2023

Non-Autoregressive Document-Level Machine Translation

EMNLP 2023long findings

Non-autoregressive translation (NAT) models achieve comparable performance and superior speed compared to auto-regressive translation (AT) models in the context of sentence-level machine translation (MT). However, their abilities are unexplored in document-level MT, hindering their usage in real sce…

Cited by 0SourcecodeScholar
2023

Re$^3$Dial: Retrieve, Reorganize and Rescale Conversations for Long-Turn Open-Domain Dialogue Pre-training

EMNLP 2023long main

Pre-training on large-scale open-domain dialogue data can substantially improve the performance of dialogue models. However, the pre-trained dialogue model's ability to utilize long-range context is limited due to the scarcity of long-turn dialogue sessions. Most dialogues in existing pre-training c…

Cited by 0SourceScholar
2022

CTRLEval: An Unsupervised Reference-Free Metric for Evaluating Controlled Text Generation

ACL 2022long

Existing reference-free metrics have obvious limitations for evaluating controlled text generation models. Unsupervised metrics can only provide a task-agnostic evaluation result which correlates weakly with human judgments, whereas supervised ones may overfit task-specific data with poor generaliza…

2022

Contextual Representation Learning beyond Masked Language Modeling

ACL 2022long

Currently, masked language modeling (e.g., BERT) is the prime choice to learn contextualized representations. Due to the pervasiveness, it naturally raises an interesting question: how do masked language models (MLMs) learn contextual representations? In this work, we analyze the learning dynamics o…

2022

Directed Acyclic Transformer for Non-Autoregressive Machine Translation

ICML 2022spotlight

Non-autoregressive Transformers (NATs) significantly reduce the decoding latency by generating all tokens in parallel. However, such independent predictions prevent NATs from capturing the dependencies between the tokens for generating multiple possible translations. In this paper, we propose Direct…

2022

E-KAR: A Benchmark for Rationalizing Natural Language Analogical Reasoning

ACL 2022findings

The ability to recognize analogies is fundamental to human cognition. Existing benchmarks to test word analogy do not reveal the underneath process of analogical reasoning of neural models. Holding the belief that models capable of reasoning should be right for the right reasons, we propose a first-…

Cited by 35SourcePDFScholar
2022

LOREN: Logic-Regularized Reasoning for Interpretable Fact Verification

AAAI 2022technical

Given a natural language statement, how to verify its veracity against a large-scale textual knowledge source like Wikipedia? Most existing neural models make predictions without giving clues about which part of a false claim goes wrong. In this paper, we propose LOREN, an approach for interpretable…

2022

MTG: A Benchmark Suite for Multilingual Text Generation

NAACL 2022findings

We introduce MTG, a new benchmark suite for training and evaluating multilingual text generation. It is the first-proposed multilingual multiway text generation dataset with the largest human-annotated data (400k). It includes four generation tasks (story generation, question generation, title gener…

2022

Non-autoregressive Translation with Layer-Wise Prediction and Deep Supervision

AAAI 2022technical

How do we perform efficient inference while retaining high translation quality? Existing neural machine translation models, such as Transformer, achieve high performance, but they decode words one by one, which is inefficient. Recent non-autoregressive translation models speed up the inference, but…

2022

On the Safety of Conversational Models: Taxonomy, Dataset, and Benchmark

ACL 2022findings

Dialogue safety problems severely limit the real-world deployment of neural conversational models and have attracted great research interests recently. However, dialogue safety problems remain under-defined and the corresponding dataset is scarce. We propose a taxonomy for dialogue safety specifical…

2022

Out-of-Distribution Identification: Let Detector Tell Which I Am Not Sure

ECCV 2022poster

"The superior performance of object detectors is often established under the condition that the test samples are in the same distribution as the training data. However, in most practical applications, out-of-distribution (OOD) instances are inevitable and usually lead to detection uncertainty. In th…

Cited by 9SourcePDFScholar
2022

PSS: Progressive Sample Selection for Open-World Visual Representation Learning

ECCV 2022poster

"We propose a practical open-world representation learning setting where the objective is to learn the representations for unseen categories without prior knowledge or access to images associated with these novel categories during training. Existing open-world representation learning methods, howeve…

2022

Prompt-based Connective Prediction Method for Fine-grained Implicit Discourse Relation Recognition

EMNLP 2022finding

Due to the absence of connectives, implicit discourse relation recognition (IDRR) is still a challenging and crucial task in discourse analysis. Most of the current work adopted multitask learning to aid IDRR through explicit discourse relation recognition (EDRR) or utilized dependencies between dis…

2022

ROSE: Robust Selective Fine-tuning for Pre-trained Language Models

EMNLP 2022main

Even though the large-scale language models have achieved excellent performances, they suffer from various adversarial attacks.A large body of defense methods has been proposed. However, they are still limited due to redundant attack search spaces and the inability to defend against various types of…

2022

Regularized Molecular Conformation Fields

NeurIPS 2022accept

Predicting energetically favorable 3-dimensional conformations of organic molecules from molecular graph plays a fundamental role in computer-aided drug discovery research. However, effectively exploring the high-dimensional conformation space to identify (meta) stable conformers is anything but tri…

Cited by 7SourcePDFScholar
2022

Rethinking Document-level Neural Machine Translation

ACL 2022findings

This paper does not aim at introducing a novel model for document-level neural machine translation. Instead, we head back to the original Transformer model and hope to answer the following question: Is the capacity of current models strong enough for document-level translation? Interestingly, we obs…

2022

Towards Regression-Free Neural Networks for Diverse Compute Platforms

ECCV 2022poster

"With the shift towards on-device deep learning, ensuring a consistent behavior of an AI service across diverse compute platforms becomes tremendously important. Our work tackles the emergent problem of reducing predictive in-consistencies arising as negative flips: test samples that are correctly p…

Cited by 4SourcePDFScholar
2022

Unsupervised Editing for Counterfactual Stories

AAAI 2022technical

Creating what-if stories requires reasoning about prior statements and possible outcomes of the changed conditions. One can easily generate coherent endings under new conditions, but it would be challenging for current systems to do it with minimal changes to the original story. Therefore, one major…

2022

latent-GLAT: Glancing at Latent Variables for Parallel Text Generation

ACL 2022long

Recently, parallel text generation has received widespread attention due to its success in generation efficiency. Although many advanced techniques are proposed to improve its generation quality, they still need the help of an autoregressive model for training to overcome the one-to-many multi-modal…

2022

switch-GLAT: Multilingual Parallel Machine Translation Via Code-Switch Decoder

ICLR 2022poster

Multilingual machine translation aims to develop a single model for multiple language directions. However, existing multilingual models based on Transformer are limited in terms of both translation performance and inference speed. In this paper, we propose switch-GLAT, a non-autoregressive multiling…

Cited by 13SourcePDFScholar
2021

ACMo: Angle-Calibrated Moment Methods for Stochastic Optimization

AAAI 2021technical

Stochastic gradient descent (SGD) is a widely used method for its outstanding generalization ability and simplicity. Adaptive gradient methods have been proposed to further accelerate the optimization process. In this paper, we revisit existing adaptive gradient optimization methods with a new inter…

2021

Consecutive Decoding for Speech-to-text Translation

AAAI 2021technical

Speech-to-text translation (ST), which directly translates the source language speech to the target language text, has attracted intensive attention recently. However, the combination of speech recognition and machine translation in a single model poses a heavy burden on the direct cross-modal cross…

2021

Deep Graph-neighbor Coherence Preserving Network for Unsupervised Cross-modal Hashing

AAAI 2021technical

Unsupervised cross-modal hashing (UCMH) has become a hot topic recently. Current UCMH focuses on exploring data similarities. However, current UCMH methods calculate the similarity between two data, mainly relying on the two data's cross-modal features. These methods suffer from inaccurate similarit…

2021

Duplex Sequence-to-Sequence Learning for Reversible Machine Translation

NeurIPS 2021poster

Sequence-to-sequence learning naturally has two directions. How to effectively utilize supervision signals from both directions? Existing approaches either require two separate models, or a multitask-learned model but with inferior performance. In this paper, we propose REDER (Reversible Duplex Tran…

2021

EARL: Informative Knowledge-Grounded Conversation Generation with Entity-Agnostic Representation Learning

EMNLP 2021main

Generating informative and appropriate responses is challenging but important for building human-like dialogue systems. Although various knowledge-grounded conversation models have been proposed, these models have limitations in utilizing knowledge that infrequently occurs in the training data, not…

2021

Embracing Uncertainty: Decoupling and De-Bias for Robust Temporal Grounding

CVPR 2021poster

Temporal grounding aims to localize temporal boundaries within untrimmed videos by language queries, but it faces the challenge of two types of inevitable human uncertainties: query uncertainty and label uncertainty. The two uncertainties stem from human subjectivity, leading to limited generalizati…

Cited by 62PDFScholar
2021

Glancing Transformer for Non-Autoregressive Neural Machine Translation

ACL 2021long

Recent work on non-autoregressive neural machine translation (NAT) aims at improving the efficiency by parallel decoding without sacrificing the quality. However, existing NAT methods are either inferior to Transformer or require multiple decoding passes, leading to reduced speedup. We propose the G…

2021

Improving Sign Language Translation With Monolingual Data by Sign Back-Translation

CVPR 2021poster

Despite existing pioneering works on sign language translation (SLT), there is a non-trivial obstacle, i.e., the limited quantity of parallel sign-text data. To tackle this parallel data bottleneck, we propose a sign back-translation (SignBT) approach, which incorporates massive spoken language text…

Cited by 249PDFScholar
2021

Learning Logic Rules for Document-Level Relation Extraction

EMNLP 2021main

Document-level relation extraction aims to identify relations between entities in a whole document. Prior efforts to capture long-range dependencies have relied heavily on implicitly powerful representations learned through (graph) neural networks, which makes the model less transparent. To tackle t…

2021

Listen, Understand and Translate: Triple Supervision Decouples End-to-end Speech-to-text Translation

AAAI 2021technical

An end-to-end speech-to-text translation (ST) takes audio in a source language and outputs the text in a target language. Existing methods are limited by the amount of parallel corpus. Can we build a system to fully utilize signals in a parallel ST corpus? We are inspired by human understanding syst…

2021

MARS: Markov Molecular Sampling for Multi-objective Drug Discovery

ICLR 2021spotlight

Searching for novel molecules with desired chemical properties is crucial in drug discovery. Existing work focuses on developing neural models to generate either molecular sequences or chemical graphs. However, it remains a big challenge to find novel and diverse compounds satisfying several propert…

2021

NUANCED: Natural Utterance Annotation for Nuanced Conversation with Estimated Distributions

EMNLP 2021finding

Existing conversational systems are mostly agent-centric, which assumes the user utterances will closely follow the system ontology. However, in real-world scenarios, it is highly desirable that users can speak freely and naturally. In this work, we attempt to build a user-centric dialogue system fo…

2021

UniRE: A Unified Label Space for Entity Relation Extraction

ACL 2021long

Many joint entity relation extraction models setup two separated label spaces for the two sub-tasks (i.e., entity detection and relation classification). We argue that this setting may hinder the information interaction between entities and relations. In this work, we propose to eliminate the differ…

2021

Vocabulary Learning via Optimal Transport for Neural Machine Translation

ACL 2021long

The choice of token vocabulary affects the performance of machine translation. This paper aims to figure out what is a good vocabulary and whether we can find the optimal vocabulary without trial training. To answer these questions, we first provide an alternative understanding of vocabulary from th…

2020

Dispersed Exponential Family Mixture VAEs for Interpretable Text Generation

ICML 2020poster

Deep generative models are commonly used for generating images and text. Interpretability of these models is one important pursuit, other than the generation quality. Variational auto-encoder (VAE) with Gaussian distribution as prior has been successfully applied in text generation, but it is hard t…

2020

Improving Maximum Likelihood Training for Text Generation with Density Ratio Estimation

AISTATS 2020poster

Autoregressive neural sequence generative models trained by Maximum Likelihood Estimation suffer the exposure bias problem in practical finite sample scenarios. The crux is that the number of training samples for Maximum Likelihood Estimation is usually limited and the input data distributions are d…

Cited by 7SourcePDFScholar
2020

SharinGAN: Combining Synthetic and Real Data for Unsupervised Geometry Estimation

CVPR 2020poster

We propose a novel method for combining synthetic and real images when training networks to determine geometric information from a single image. We suggest a method for mapping both image types into a single, shared domain. This is connected to a primary network for end-to-end training. Ideally, thi…

Cited by 67PDFcodeScholar
2020

Where, What, Whether: Multi-Modal Learning Meets Pedestrian Detection

CVPR 2020poster

Pedestrian detection benefits greatly from deep convolutional neural networks (CNNs). However, it is inherently hard for CNNs to handle situations in the presence of occlusion and scale variation. In this paper, we propose W^3Net, which attempts to address above challenges by decomposing the pedestr…

Cited by 39PDFScholar
2019

A Novel Monolithic Soft Robotic Thumb for an Anthropomorphic Prosthetic Hand

RA-L 2019

The thumb of a natural hand or a prosthetic hand plays a significant role in realizing a hand's grasping and manipulation activities. This requires that mechanical design of a prosthetic hand should allow its thumb to perform both abduction/adduction and flexion/extension in order to mimic a natural

Cited by 51SourceScholar
2019

Transferable Positive/negative Speech Emotion Recognition via Class-wise Adversarial Domain Adaptation

ICASSP 2019accepted

Speech emotion recognition plays an important role in building more intelligent and human-like agents. Due to the difficulty of collecting speech emotional data, an increasingly popular solution is leveraging a related and rich source corpus to help address the target corpus. However, domain shift b…

Cited by 0SourceScholar
2019

Visual Relationship Recognition via Language and Position Guided Attention

ICASSP 2019accepted

Visual relationship recognition, as a challenging task used to distinguish the interactions between object pairs, has received much attention recently. Considering the fact that most visual relationships are semantic concepts defined by human beings, there are many human knowledge, or priors, hidden…

Cited by 0SourceScholar
2019

Why Do Neural Dialog Systems Generate Short and Meaningless Replies? a Comparison between Dialog and Translation

ICASSP 2019accepted

This paper addresses the question: In neural dialog systems, why do sequence-to-sequence (Seq2Seq) neural networks generate short and meaningless replies for open-domain response generation? We conjecture that in a dialog system, due to the randomness of spoken language, there may be multiple equall…

Cited by 0SourceScholar
2018

BRITS: Bidirectional Recurrent Imputation for Time Series

NeurIPS 2018poster

Time series are widely used as signals in many classification/regression tasks. It is ubiquitous that time series contains many missing values. Given multiple correlated time series data, how to fill in missing values and to predict their class labels? Existing imputation methods often impose strong…

2018

Label Denoising Adversarial Network (LDAN) for Inverse Lighting of Faces

CVPR 2018poster

Lighting estimation from faces is an important task and has applications in many areas such as image editing, intrinsic image decomposition, and image forgery detection. We propose to train a deep Convolutional Neural Network (CNN) to regress lighting parameters from a single face image. Lacking mas…

Cited by 23SourcePDFScholar
2016

Hypothesis Testing in Unsupervised Domain Adaptation with Applications in Alzheimer's Disease

NeurIPS 2016poster

Consider samples from two different data sources $\{\mathbf{x_s^i}\} \sim P_{\rm source}$ and $\{\mathbf{x_t^i}\} \sim P_{\rm target}$. We only observe their transformed versions $h(\mathbf{x_s^i})$ and $g(\mathbf{x_t^i})$, for some known function class $h(\cdot)$ and $g(\cdot)$. Our goal is to perf…

Cited by 20SourcePDFScholar