arXiv subjects

Logan Hallee

Publications and source records attributed to Logan Hallee.

3 recordsLinked to original sources

arXiv2026

Dual Triangle Attention: Effective Bidirectional Attention Without Positional Embeddings

Bidirectional transformers are the foundation of many sequence modeling tasks across natural, biological, and chemical language domains, but they are permutation-invariant without explicit positional embeddings. In contrast, unidirectional attention inherently encodes positional information through its triangular mask, enabling models to operate without positional embeddings altogether. Here, we introduce Dual Triangle Attention, a novel bidirectional attention mechanism that separates the query-key subspace of each attention head into two complementary triangular masks: one that attends to past-and-self positions and one that attends to future-and-self positions. This design provides bidirectional context while maintaining the causal mask's implicit positional inductive bias in both directions. Using PyTorch's flex_attention, Dual Triangle Attention is implemented as a single compiled kernel call with no additional parameters beyond standard multi-head attention. We evaluated Dual Triangle Attention across three settings: (1) a synthetic argmax position probe, (2) masked language modeling (MLM) on natural language, and (3) MLM on protein sequences. In the argmax task, both Dual Triangle Attention and causal attention learn positional information without explicit positional embeddings, whereas standard bidirectional attention cannot. In the MLM experiments, Dual Triangle Attention with Rotary Positional Embeddings (RoPE) achieved the best context extension performance and strong performance across the board. These findings suggest that Dual Triangle Attention is a viable attention mechanism for bidirectional transformers, with or without positional embeddings.

q-bio.QM↗

arXiv2025

Diffusion Sequence Models for Enhanced Protein Representation and Generation

Proteins are fundamental to biology, executing diverse functions through complex physicochemical interactions, and they hold transformative potential across medicine, materials science, and environmental applications. Protein Language Models (pLMs) aim to unlock insights from the vast space of unlabeled protein sequences by learning rich, semantic representations from primary sequences via masked language modeling. However, these models typically exhibit limited generative capacity. In this work, we introduce the Diffusion Sequence Model (DSM), a novel pLM trained with masked diffusion to enable both high-quality representation learning and generative protein design. DSM builds upon the ESM2 architecture by incorporating a masked forward diffusion process inspired by the LLaDA framework. After training, DSM is capable of generating diverse, biomimetic sequences that align with expected amino acid compositions, secondary structures, and predicted functions, even with 90\% token corruption. Furthermore, DSM's learned representations match or exceed those of similarly sized pLMs on downstream tasks. We also introduce DSM(ppi), a variant fine-tuned to generate protein binders by attending to target sequences. We demonstrate DSM(ppi)'s effectiveness on the challenging Bench-tested Binder Benchmark (BenchBB), where both DSM and DSM(ppi) produce candidates with superior predicted binding affinity compared to known binders. Our results establish masked diffusion as a powerful paradigm for unifying protein representation and generation in a single framework.

q-bio.BM↗

arXiv2024

Contrastive Learning and Mixture of Experts Enables Precise Vector Embeddings

The advancement of transformer neural networks has significantly elevated the capabilities of sentence similarity models, but they still struggle with highly discriminative tasks and may produce sub-optimal representations of important documents like scientific literature. With the increased reliance on retrieval augmentation and search, representing diverse documents as concise and descriptive vectors is crucial. This paper improves upon the vectors embeddings of scientific text by assembling niche datasets using co-citations as a similarity metric, focusing on biomedical domains. We apply a novel Mixture of Experts (MoE) extension pipeline to pretrained BERT models, where every multi-layer perceptron section is enlarged and copied into multiple distinct experts. Our MoE variants perform well over $N$ scientific domains with $N$ dedicated experts, whereas standard BERT models excel in only one domain at a time. Notably, extending just a single transformer block to MoE captures 85% of the benefit seen from full MoE extension at every layer. This holds promise for versatile and efficient One-Size-Fits-All transformer networks for numerically representing diverse inputs. Our methodology marks advancements in representation learning and holds promise for enhancing vector database search and compilation.

cs.LG↗