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Huayang Huang

Publications and source records attributed to Huayang Huang.

11 recordsLinked to original sources

RetroMPA: A Molecular Property-Aware Auxiliary Framework for Enhancing Retrosynthesis Prediction

Retrosynthesis is a cornerstone of drug discovery and organic synthesis. While data-driven deep learning models have shown remarkable progress, they autonomously learn reaction patterns from extensive datasets with limited integration of established chemical knowledge as priors. To address this limitation, we introduce RetroMPA, a molecular property-aware, post-hoc enhancement module that injects chemical knowledge into the retrosynthesis pipeline. Rather than functioning as an independent SMILES sequence generator, RetroMPA is a broadly applicable, model-agnostic chemical filter designed to recalibrate and optimize the predictive pathways of existing algorithms. This plug-and-play framework integrates seamlessly with a range of data-driven retrosynthesis methods, enhancing outputs without modifying model architecture or requiring resource-intensive retraining. By leveraging a property-aware latent embedding space, RetroMPA consistently improves top-1 accuracy across eight representative retrosynthesis models by an average of 5.50% on USPTO-50K. Furthermore, we validate its scalability on the large-scale USPTO-Full dataset, achieving an average improvement of about 2.03% across both template-based and template-free architectures. Wet-lab experiments provide preliminary support for the practical utility of the framework. These syntheses confirmed viable, previously unreported substrate combinations for classic reaction paradigms---specifically, Suzuki-Miyaura coupling, Bucherer reaction, and Friedel-Crafts acylation---suggesting that RetroMPA can operate beyond mere data fitting. The code is open-sourced at https://github.com/MengzhouLu/RetroMPA.

cs.LG

SIFT: Self-Imagination Fine-Tuning for Physically Plausible Motion in Video Diffusion Models

Recent advances in video diffusion models have greatly improved visual fidelity, yet their generated motions often violate physical plausibility. We observe a common kinematic failure, "motion entanglement", the unintended coupling of independent motion sources, such as camera movement and object motion. We identify that this issue stems from data bias and the reconstruction-based training design of diffusion models. Training on noisy videos that still retain coarse motion cues inadvertently encourages the model to replicate existing motion without an incentive to learn how to model kinematically-grounded motions. To address this, we propose a Self-Imagination Fine-Tuning (SIFT) paradigm, which enables the model to learn from its own generated videos rather than directly reconstructing real ones, breaking the reconstruction shortcut. We further employ motion-aware discriminative supervision and a progressive hard-case replay strategy to stabilize and accelerate learning. By leveraging freely-generated text prompts, our method can densely cover a broad motion space, including rare or finely-disentangled scenarios that would be costly to collect as video data. Extensive experiments demonstrate that our approach substantially improves the physical realism, motion disentanglement, and controllability of generated videos.

cs.CV

Restoring Initial Noise Sensitivity in Text-to-Image Distillation via Geometric Alignment

Generative distillation significantly accelerates text-to-image (T2I) generation by compressing multi-step trajectories into few-step student models while preserving perceptual quality. However, existing methods primarily optimize efficiency and output fidelity, often neglecting critical properties of the original trajectory. In this work, we identify a key missing property: sensitivity to initial noise, whose degradation impairs downstream control methods relying on noise-based optimization and manipulation. We trace this issue to standard distillation objectives that enforce pointwise output alignment, inadvertently flattening the input-output landscape and suppressing the teacher's local geometric structure. To address this, we propose Geometry-Aware Distillation (GAD), a sensitivity-preserving framework that aligns the local functional behavior of teacher and student models. Specifically, GAD matches Jacobian-vector products with respect to input noise, enabling the student to reproduce the teacher's differential response to perturbations. Extensive experiments across multiple T2I paradigms and noise-driven control tasks demonstrate that GAD significantly restores sensitivity and improves diversity while maintaining high visual fidelity. Code is available at https://github.com/Hannah1102/GAD.

cs.CV

Towards One-step Causal Video Generation via Adversarial Self-Distillation

Recent hybrid video generation models combine autoregressive temporal dynamics with diffusion-based spatial denoising, but their sequential, iterative nature leads to error accumulation and long inference times. In this work, we propose a distillation-based framework for efficient causal video generation that enables high-quality synthesis with extremely limited denoising steps. Our approach builds upon the Distribution Matching Distillation (DMD) framework and proposes a novel Adversarial Self-Distillation (ASD) strategy, which aligns the outputs of the student model's n-step denoising process with its (n+1)-step version at the distribution level. This design provides smoother supervision by bridging small intra-student gaps and more informative guidance by combining teacher knowledge with locally consistent student behavior, substantially improving training stability and generation quality in extremely few-step scenarios (e.g., 1-2 steps). In addition, we present a First-Frame Enhancement (FFE) strategy, which allocates more denoising steps to the initial frames to mitigate error propagation while applying larger skipping steps to later frames. Extensive experiments on VBench demonstrate that our method surpasses state-of-the-art approaches in both one-step and two-step video generation. Notably, our framework produces a single distilled model that flexibly supports multiple inference-step settings, eliminating the need for repeated re-distillation and enabling efficient, high-quality video synthesis.

cs.CV

BNMusic: Blending Environmental Noises into Personalized Music

While being disturbed by environmental noises, the acoustic masking technique is a conventional way to reduce the annoyance in audio engineering that seeks to cover up the noises with other dominant yet less intrusive sounds. However, misalignment between the dominant sound and the noise-such as mismatched downbeats-often requires an excessive volume increase to achieve effective masking. Motivated by recent advances in cross-modal generation, in this work, we introduce an alternative method to acoustic masking, aiming to reduce the noticeability of environmental noises by blending them into personalized music generated based on user-provided text prompts. Following the paradigm of music generation using mel-spectrogram representations, we propose a Blending Noises into Personalized Music (BNMusic) framework with two key stages. The first stage synthesizes a complete piece of music in a mel-spectrogram representation that encapsulates the musical essence of the noise. In the second stage, we adaptively amplify the generated music segment to further reduce noise perception and enhance the blending effectiveness, while preserving auditory quality. Our experiments with comprehensive evaluations on MusicBench, EPIC-SOUNDS, and ESC-50 demonstrate the effectiveness of our framework, highlighting the ability to blend environmental noise with rhythmically aligned, adaptively amplified, and enjoyable music segments, minimizing the noticeability of the noise, thereby improving overall acoustic experiences. Project page: https://d-fas.github.io/BNMusic_page/.

cs.SD

The Silent Assistant: NoiseQuery as Implicit Guidance for Goal-Driven Image Generation

In this work, we introduce NoiseQuery as a novel method for enhanced noise initialization in versatile goal-driven text-to-image (T2I) generation. Specifically, we propose to leverage an aligned Gaussian noise as implicit guidance to complement explicit user-defined inputs, such as text prompts, for better generation quality and controllability. Unlike existing noise optimization methods designed for specific models, our approach is grounded in a fundamental examination of the generic finite-step noise scheduler design in diffusion formulation, allowing better generalization across different diffusion-based architectures in a tuning-free manner. This model-agnostic nature allows us to construct a reusable noise library compatible with multiple T2I models and enhancement techniques, serving as a foundational layer for more effective generation. Extensive experiments demonstrate that NoiseQuery enables fine-grained control and yields significant performance boosts not only over high-level semantics but also over low-level visual attributes, which are typically difficult to specify through text alone, with seamless integration into current workflows with minimal computational overhead.

cs.CV

ROBIN: Robust and Invisible Watermarks for Diffusion Models with Adversarial Optimization

Watermarking generative content serves as a vital tool for authentication, ownership protection, and mitigation of potential misuse. Existing watermarking methods face the challenge of balancing robustness and concealment. They empirically inject a watermark that is both invisible and robust and passively achieve concealment by limiting the strength of the watermark, thus reducing the robustness. In this paper, we propose to explicitly introduce a watermark hiding process to actively achieve concealment, thus allowing the embedding of stronger watermarks. To be specific, we implant a robust watermark in an intermediate diffusion state and then guide the model to hide the watermark in the final generated image. We employ an adversarial optimization algorithm to produce the optimal hiding prompt guiding signal for each watermark. The prompt embedding is optimized to minimize artifacts in the generated image, while the watermark is optimized to achieve maximum strength. The watermark can be verified by reversing the generation process. Experiments on various diffusion models demonstrate the watermark remains verifiable even under significant image tampering and shows superior invisibility compared to other state-of-the-art robust watermarking methods. Code is available at https://github.com/Hannah1102/ROBIN.

cs.CV

Implicit Bias Injection Attacks against Text-to-Image Diffusion Models

The proliferation of text-to-image diffusion models (T2I DMs) has led to an increased presence of AI-generated images in daily life. However, biased T2I models can generate content with specific tendencies, potentially influencing people's perceptions. Intentional exploitation of these biases risks conveying misleading information to the public. Current research on bias primarily addresses explicit biases with recognizable visual patterns, such as skin color and gender. This paper introduces a novel form of implicit bias that lacks explicit visual features but can manifest in diverse ways across various semantic contexts. This subtle and versatile nature makes this bias challenging to detect, easy to propagate, and adaptable to a wide range of scenarios. We further propose an implicit bias injection attack framework (IBI-Attacks) against T2I diffusion models by precomputing a general bias direction in the prompt embedding space and adaptively adjusting it based on different inputs. Our attack module can be seamlessly integrated into pre-trained diffusion models in a plug-and-play manner without direct manipulation of user input or model retraining. Extensive experiments validate the effectiveness of our scheme in introducing bias through subtle and diverse modifications while preserving the original semantics. The strong concealment and transferability of our attack across various scenarios further underscore the significance of our approach. Code is available at https://github.com/Hannah1102/IBI-attacks.

cs.CV

Redistribute Ensemble Training for Mitigating Memorization in Diffusion Models

Diffusion models, known for their tremendous ability to generate high-quality samples, have recently raised concerns due to their data memorization behavior, which poses privacy risks. Recent methods for memory mitigation have primarily addressed the issue within the context of the text modality in cross-modal generation tasks, restricting their applicability to specific conditions. In this paper, we propose a novel method for diffusion models from the perspective of visual modality, which is more generic and fundamental for mitigating memorization. Directly exposing visual data to the model increases memorization risk, so we design a framework where models learn through proxy model parameters instead. Specially, the training dataset is divided into multiple shards, with each shard training a proxy model, then aggregated to form the final model. Additionally, practical analysis of training losses illustrates that the losses for easily memorable images tend to be obviously lower. Thus, we skip the samples with abnormally low loss values from the current mini-batch to avoid memorizing. However, balancing the need to skip memorization-prone samples while maintaining sufficient training data for high-quality image generation presents a key challenge. Thus, we propose IET-AGC+, which redistributes highly memorizable samples between shards, to mitigate these samples from over-skipping. Furthermore, we dynamically augment samples based on their loss values to further reduce memorization. Extensive experiments and analysis on four datasets show that our method successfully reduces memory capacity while maintaining performance. Moreover, we fine-tune the pre-trained diffusion models, e.g., Stable Diffusion, and decrease the memorization score by 46.7\%, demonstrating the effectiveness of our method. Code is available in: https://github.com/liuxiao-guan/IET_AGC.

cs.CV

Rethinking the Intermediate Features in Adversarial Attacks: Misleading Robotic Models via Adversarial Distillation

Language-conditioned robotic learning has significantly enhanced robot adaptability by enabling a single model to execute diverse tasks in response to verbal commands. Despite these advancements, security vulnerabilities within this domain remain largely unexplored. This paper addresses this gap by proposing a novel adversarial prompt attack tailored to language-conditioned robotic models. Our approach involves crafting a universal adversarial prefix that induces the model to perform unintended actions when added to any original prompt. We demonstrate that existing adversarial techniques exhibit limited effectiveness when directly transferred to the robotic domain due to the inherent robustness of discretized robotic action spaces. To overcome this challenge, we propose to optimize adversarial prefixes based on continuous action representations, circumventing the discretization process. Additionally, we identify the beneficial impact of intermediate features on adversarial attacks and leverage the negative gradient of intermediate self-attention features to further enhance attack efficacy. Extensive experiments on VIMA models across 13 robot manipulation tasks validate the superiority of our method over existing approaches and demonstrate its transferability across different model variants.

cs.LG

Hijacking Attacks against Neural Networks by Analyzing Training Data

Backdoors and adversarial examples are the two primary threats currently faced by deep neural networks (DNNs). Both attacks attempt to hijack the model behaviors with unintended outputs by introducing (small) perturbations to the inputs. Backdoor attacks, despite the high success rates, often require a strong assumption, which is not always easy to achieve in reality. Adversarial example attacks, which put relatively weaker assumptions on attackers, often demand high computational resources, yet do not always yield satisfactory success rates when attacking mainstream black-box models in the real world. These limitations motivate the following research question: can model hijacking be achieved more simply, with a higher attack success rate and more reasonable assumptions? In this paper, we propose CleanSheet, a new model hijacking attack that obtains the high performance of backdoor attacks without requiring the adversary to tamper with the model training process. CleanSheet exploits vulnerabilities in DNNs stemming from the training data. Specifically, our key idea is to treat part of the clean training data of the target model as "poisoned data," and capture the characteristics of these data that are more sensitive to the model (typically called robust features) to construct "triggers." These triggers can be added to any input example to mislead the target model, similar to backdoor attacks. We validate the effectiveness of CleanSheet through extensive experiments on 5 datasets, 79 normally trained models, 68 pruned models, and 39 defensive models. Results show that CleanSheet exhibits performance comparable to state-of-the-art backdoor attacks, achieving an average attack success rate (ASR) of 97.5% on CIFAR-100 and 92.4% on GTSRB, respectively. Furthermore, CleanSheet consistently maintains a high ASR, when confronted with various mainstream backdoor defenses.

cs.CR