MOL-Mamba: Enhancing Molecular Representation with Structural & Electronic Insights

Molecular representation learning plays a crucial role in various downstream tasks, such as molecular property prediction and drug design. To accurately represent molecules, Graph Neural Networks (GNNs) and Graph Transformers (GTs) have shown potential in the realm of self-supervised pretraining. However, existing approaches often overlook the relationship between molecular structure and electronic information, as well as the internal semantic reasoning within molecules. This omission of fundamental chemical knowledge in graph semantics leads to incomplete molecular representations, missing the integration of structural and electronic data. To address these issues, we introduce MOL-Mamba, a framework that enhances molecular representation by combining structural and electronic insights. MOL-Mamba consists of an Atom & Fragment Mamba-Graph (MG) for hierarchical structural reasoning and a Mamba-Transformer (MT) fuser for integrating molecular structure and electronic correlation learning. Additionally, we propose a Structural Distribution Collaborative Training and E-semantic Fusion Training framework to further enhance molecular representation learning. Extensive experiments demonstrate that MOL-Mamba outperforms state-of-the-art baselines across eleven chemical-biological molecular datasets. Code is available at https://github.com/xian-sh/MOL-Mamba.

Dense Audio-Visual Event Localization under Cross-Modal Consistency and Multi-Temporal Granularity Collaboration

In the field of audio-visual learning, most research tasks focus exclusively on short videos. This paper focuses on the more practical Dense Audio-Visual Event Localization (DAVEL) task, advancing audio-visual scene understanding for longer, {untrimmed} videos. This task seeks to identify and temporally pinpoint all events simultaneously occurring in both audio and visual streams. Typically, each video encompasses dense events of multiple classes, which may overlap on the timeline, each exhibiting varied durations. Given these challenges, effectively exploiting the audio-visual relations and the temporal features encoded at various granularities becomes crucial. To address these challenges, we introduce a novel \ul{CC}Net, comprising two core modules: the Cross-Modal Consistency \ul{C}ollaboration (CMCC) and the Multi-Temporal Granularity \ul{C}ollaboration (MTGC). Specifically, the CMCC module contains two branches: a cross-modal interaction branch and a temporal consistency-gated branch. The former branch facilitates the aggregation of consistent event semantics across modalities through the encoding of audio-visual relations, while the latter branch guides one modality's focus to pivotal event-relevant temporal areas as discerned in the other modality. The MTGC module includes a coarse-to-fine collaboration block and a fine-to-coarse collaboration block, providing bidirectional support among coarse- and fine-grained temporal features. Extensive experiments on the UnAV-100 dataset validate our module design, resulting in a new state-of-the-art performance in dense audio-visual event localization. The code is available at \url{https://github.com/zzhhfut/CCNet-AAAI2025}.

Multimodal Class-aware Semantic Enhancement Network for Audio-Visual Video Parsing

The Audio-Visual Video Parsing task aims to recognize and temporally localize all events occurring in either the audio or visual stream, or both. Capturing accurate event semantics for each audio/visual segment is vital. Prior works directly utilize the extracted holistic audio and visual features for intra- and cross-modal temporal interactions. However, each segment may contain multiple events, resulting in semantically mixed holistic features that can lead to semantic interference during intra- or cross-modal interactions: the event semantics of one segment may incorporate semantics of unrelated events from other segments. To address this issue, our method begins with a Class-Aware Feature Decoupling (CAFD) module, which explicitly decouples the semantically mixed features into distinct class-wise features, including multiple event-specific features and a dedicated background feature. The decoupled class-wise features enable our model to selectively aggregate useful semantics for each segment from clearly matched classes contained in other segments, preventing semantic interference from irrelevant classes. Specifically, we further design a Fine-Grained Semantic Enhancement module for encoding intra- and cross-modal relations. It comprises a Segment-wise Event Co-occurrence Modeling (SECM) block and a Local-Global Semantic Fusion (LGSF) block. The SECM exploits inter-class dependencies of concurrent events within the same timestamp with the aid of a new event co-occurrence loss. The LGSF further enhances the event semantics of each segment by incorporating relevant semantics from more informative global video features. Extensive experiments validate the effectiveness of the proposed modules and loss functions, resulting in a new state-of-the-art parsing performance.

Patch-level Sounding Object Tracking for Audio-Visual Question Answering

Answering questions related to audio-visual scenes, i.e., the AVQA task, is becoming increasingly popular. A critical challenge is accurately identifying and tracking sounding objects related to the question along the timeline. In this paper, we present a new Patch-level Sounding Object Tracking (PSOT) method. It begins with a Motion-driven Key Patch Tracking (M-KPT) module, which relies on visual motion information to identify salient visual patches with significant movements that are more likely to relate to sounding objects and questions. We measure the patch-wise motion intensity map between neighboring video frames and utilize it to construct and guide a motion-driven graph network. Meanwhile, we design a Sound-driven KPT (S-KPT) module to explicitly track sounding patches. This module also involves a graph network, with the adjacency matrix regularized by the audio-visual correspondence map. The M-KPT and S-KPT modules are performed in parallel for each temporal segment, allowing balanced tracking of salient and sounding objects. Based on the tracked patches, we further propose a Question-driven KPT (Q-KPT) module to retain patches highly relevant to the question, ensuring the model focuses on the most informative clues. The audio-visual-question features are updated during the processing of these modules, which are then aggregated for final answer prediction. Extensive experiments on standard datasets demonstrate the effectiveness of our method, achieving competitive performance even compared to recent large-scale pretraining-based approaches.

Towards Open-Vocabulary Audio-Visual Event Localization

The Audio-Visual Event Localization (AVEL) task aims to temporally locate and classify video events that are both audible and visible. Most research in this field assumes a closed-set setting, which restricts these models' ability to handle test data containing event categories absent (unseen) during training. Recently, a few studies have explored AVEL in an open-set setting, enabling the recognition of unseen events as ``unknown'', but without providing category-specific semantics. In this paper, we advance the field by introducing the Open-Vocabulary Audio-Visual Event Localization (OV-AVEL) problem, which requires localizing audio-visual events and predicting explicit categories for both seen and unseen data at inference. To address this new task, we propose the OV-AVEBench dataset, comprising 24,800 videos across 67 real-life audio-visual scenes (seen:unseen = 46:21), each with manual segment-level annotation. We also establish three evaluation metrics for this task. Moreover, we investigate two baseline approaches, one training-free and one using a further fine-tuning paradigm. Specifically, we utilize the unified multimodal space from the pretrained ImageBind model to extract audio, visual, and textual (event classes) features. The training-free baseline then determines predictions by comparing the consistency of audio-text and visual-text feature similarities. The fine-tuning baseline incorporates lightweight temporal layers to encode temporal relations within the audio and visual modalities, using OV-AVEBench training data for model fine-tuning. We evaluate these baselines on the proposed OV-AVEBench dataset and discuss potential directions for future work in this new field.

Label-anticipated Event Disentanglement for Audio-Visual Video Parsing

Audio-Visual Video Parsing (AVVP) task aims to detect and temporally locate events within audio and visual modalities. Multiple events can overlap in the timeline, making identification challenging. While traditional methods usually focus on improving the early audio-visual encoders to embed more effective features, the decoding phase -- crucial for final event classification, often receives less attention. We aim to advance the decoding phase and improve its interpretability. Specifically, we introduce a new decoding paradigm, \underline{l}abel s\underline{e}m\underline{a}ntic-based \underline{p}rojection (LEAP), that employs labels texts of event categories, each bearing distinct and explicit semantics, for parsing potentially overlapping events.LEAP works by iteratively projecting encoded latent features of audio/visual segments onto semantically independent label embeddings. This process, enriched by modeling cross-modal (audio/visual-label) interactions, gradually disentangles event semantics within video segments to refine relevant label embeddings, guaranteeing a more discriminative and interpretable decoding process. To facilitate the LEAP paradigm, we propose a semantic-aware optimization strategy, which includes a novel audio-visual semantic similarity loss function. This function leverages the Intersection over Union of audio and visual events (EIoU) as a novel metric to calibrate audio-visual similarities at the feature level, accommodating the varied event densities across modalities. Extensive experiments demonstrate the superiority of our method, achieving new state-of-the-art performance for AVVP and also enhancing the relevant audio-visual event localization task.

Advancing Weakly-Supervised Audio-Visual Video Parsing via Segment-wise Pseudo Labeling

The Audio-Visual Video Parsing task aims to identify and temporally localize the events that occur in either or both the audio and visual streams of audible videos. It often performs in a weakly-supervised manner, where only video event labels are provided, \ie, the modalities and the timestamps of the labels are unknown. Due to the lack of densely annotated labels, recent work attempts to leverage pseudo labels to enrich the supervision. A commonly used strategy is to generate pseudo labels by categorizing the known video event labels for each modality. However, the labels are still confined to the video level, and the temporal boundaries of events remain unlabeled. In this paper, we propose a new pseudo label generation strategy that can explicitly assign labels to each video segment by utilizing prior knowledge learned from the open world. Specifically, we exploit the large-scale pretrained models, namely CLIP and CLAP, to estimate the events in each video segment and generate segment-level visual and audio pseudo labels, respectively. We then propose a new loss function to exploit these pseudo labels by taking into account their category-richness and segment-richness. A label denoising strategy is also adopted to further improve the visual pseudo labels by flipping them whenever abnormally large forward losses occur. We perform extensive experiments on the LLP dataset and demonstrate the effectiveness of each proposed design and we achieve state-of-the-art video parsing performance on all types of event parsing, \ie, audio event, visual event, and audio-visual event. We also examine the proposed pseudo label generation strategy on a relevant weakly-supervised audio-visual event localization task and the experimental results again verify the benefits and generalization of our method.

TAVGBench: Benchmarking Text to Audible-Video Generation

The Text to Audible-Video Generation (TAVG) task involves generating videos with accompanying audio based on text descriptions. Achieving this requires skillful alignment of both audio and video elements. To support research in this field, we have developed a comprehensive Text to Audible-Video Generation Benchmark (TAVGBench), which contains over 1.7 million clips with a total duration of 11.8 thousand hours. We propose an automatic annotation pipeline to ensure each audible video has detailed descriptions for both its audio and video contents. We also introduce the Audio-Visual Harmoni score (AVHScore) to provide a quantitative measure of the alignment between the generated audio and video modalities. Additionally, we present a baseline model for TAVG called TAVDiffusion, which uses a two-stream latent diffusion model to provide a fundamental starting point for further research in this area. We achieve the alignment of audio and video by employing cross-attention and contrastive learning. Through extensive experiments and evaluations on TAVGBench, we demonstrate the effectiveness of our proposed model under both conventional metrics and our proposed metrics.

Object-aware Adaptive-Positivity Learning for Audio-Visual Question Answering

This paper focuses on the Audio-Visual Question Answering (AVQA) task that aims to answer questions derived from untrimmed audible videos. To generate accurate answers, an AVQA model is expected to find the most informative audio-visual clues relevant to the given questions. In this paper, we propose to explicitly consider fine-grained visual objects in video frames (object-level clues) and explore the multi-modal relations(i.e., the object, audio, and question) in terms of feature interaction and model optimization. For the former, we present an end-to-end object-oriented network that adopts a question-conditioned clue discovery module to concentrate audio/visual modalities on respective keywords of the question and designs a modality-conditioned clue collection module to highlight closely associated audio segments or visual objects. For model optimization, we propose an object-aware adaptive-positivity learning strategy that selects the highly semantic-matched multi-modal pair as positivity. Specifically, we design two object-aware contrastive loss functions to identify the highly relevant question-object pairs and audio-object pairs, respectively. These selected pairs are constrained to have larger similarity values than the mismatched pairs. The positivity-selecting process is adaptive as the positivity pairs selected in each video frame may be different. These two object-aware objectives help the model understand which objects are exactly relevant to the question and which are making sounds. Extensive experiments on the MUSIC-AVQA dataset demonstrate the proposed method is effective in finding favorable audio-visual clues and also achieves new state-of-the-art question-answering performance.

Fine-grained Audible Video Description

We explore a new task for audio-visual-language modeling called fine-grained audible video description (FAVD). It aims to provide detailed textual descriptions for the given audible videos, including the appearance and spatial locations of each object, the actions of moving objects, and the sounds in videos. Existing visual-language modeling tasks often concentrate on visual cues in videos while undervaluing the language and audio modalities. On the other hand, FAVD requires not only audio-visual-language modeling skills but also paragraph-level language generation abilities. We construct the first fine-grained audible video description benchmark (FAVDBench) to facilitate this research. For each video clip, we first provide a one-sentence summary of the video, ie, the caption, followed by 4-6 sentences describing the visual details and 1-2 audio-related descriptions at the end. The descriptions are provided in both English and Chinese. We create two new metrics for this task: an EntityScore to gauge the completeness of entities in the visual descriptions, and an AudioScore to assess the audio descriptions. As a preliminary approach to this task, we propose an audio-visual-language transformer that extends existing video captioning model with an additional audio branch. We combine the masked language modeling and auto-regressive language modeling losses to optimize our model so that it can produce paragraph-level descriptions. We illustrate the efficiency of our model in audio-visual-language modeling by evaluating it against the proposed benchmark using both conventional captioning metrics and our proposed metrics. We further put our benchmark to the test in video generation models, demonstrating that employing fine-grained video descriptions can create more intricate videos than using captions.