Related papers: Physical probes expose and alleviate chemical-envi…
Preserving maximal information is one of principles of designing self-supervised learning methodologies. To reach this goal, contrastive learning adopts an implicit way which is contrasting image pairs. However, we believe it is not fully…
Models that learn spurious correlations from training data often fail when deployed in new environments. While many methods aim to learn invariant representations to address this, they often underperform standard empirical risk minimization…
Machine learning (ML) has seen promising developments in materials science, yet its efficacy largely depends on detailed crystal structural data, which are often complex and hard to obtain, limiting their applicability in real-world…
Molecule and text representation learning has gained increasing interest due to its potential for enhancing the understanding of chemical information. However, existing models often struggle to capture subtle differences between molecules…
Context-aware methods have achieved remarkable advancements in supervised scene text recognition by leveraging semantic priors from words. Considering the heterogeneity of text and background in STR, we propose that such contextual priors…
Noise ubiquitously exists in signals due to numerous factors including physical, electronic, and environmental effects. Traditional methods of symbolic regression, such as genetic programming or deep learning models, aim to find the most…
Human perception integrates multiple modalities, such as vision, hearing, and language, into a unified understanding of the surrounding reality. While recent multimodal models have achieved significant progress by aligning pairs of…
Although the self-supervised pre-training of transformer models has resulted in the revolutionizing of natural language processing (NLP) applications and the achievement of state-of-the-art results with regard to various benchmarks, this…
Deep learning has demonstrated expert-level performance in melanoma classification, positioning it as a powerful tool in clinical dermatology. However, model opacity and the lack of interpretability remain critical barriers to clinical…
Recently, contrastive learning has been shown to be effective in improving pre-trained language models (PLM) to derive high-quality sentence representations. It aims to pull close positive examples to enhance the alignment while push apart…
Accurate molecular property prediction is a critical challenge with wide-ranging applications in chemistry, materials science, and drug discovery. Molecular representation methods, including fingerprints and graph neural networks (GNNs),…
Learning representations that generalize well to unknown downstream tasks is a central challenge in representation learning. Existing approaches such as contrastive learning, self-supervised masking, and denoising auto-encoders address this…
The discovery of anticancer therapeutics has traditionally treated organic small molecules and metal-based coordination complexes as separate chemical domains, limiting knowledge transfer despite their shared biological objectives. This…
Semantic overlap among land-cover categories, highly imbalanced label distributions, and complex inter-class co-occurrence patterns constitute significant challenges for multi-label remote-sensing image retrieval. In this article,…
Human action recognition (HAR) with multi-modal inputs (RGB-D, skeleton, point cloud) can achieve high accuracy but typically relies on large labeled datasets and degrades sharply when sensors fail or are noisy. We present Robust…
Deriving multimodal representations of audio and lexical inputs is a central problem in Natural Language Understanding (NLU). In this paper, we present Contrastive Aligned Audio-Language Multirate and Multimodal Representations (CALM), an…
Learning effective visual representations without human supervision is a long-standing problem in computer vision. Recent advances in self-supervised learning algorithms have utilized contrastive learning, with methods such as SimCLR, which…
Recent advances in molecular representation integrates molecular topological and visual modalities, opening new avenues for precise Molecular Relational Learning (MRL). Existing MRL methods focus on intra-domain modeling, and their inherent…
Contrastive learning has emerged as a powerful method in deep learning, excelling at learning effective representations through contrasting samples from different distributions. However, dimensional collapse, where embeddings converge into…
Machine learning (ML) of quantum mechanical properties shows promise for accelerating chemical discovery. For transition metal chemistry where accurate calculations are computationally costly and available training data sets are small, the…