activity
20212026
most citedMol-Instructions: A Large-Scale Biomolecular Instruction Dataset for Large Language Models

40 citations · 98 across the 12 of their papers we have counts for

collaborators

12 papers

cs.AI2026

Unraveling the Real Working Mechanism and Inherent Flaws of GAE: A Method for Interpreting Transformer Processes from an Economic Perspective

Yongjin Cui, Xiaohui Fan

We observe a phenomenon that current algorithmic research in the field of explainable artificial intelligence primarily pursues better performance on several proxy metrics. On the…

cs.CV2026

Generic Interpretation Approach for Transformer Models Incorporating Heterogenous Attention Structures

Yongjin Cui, Xiaohui Fan, Huajun Chen

Transformer has significantly propelled the development of artificial intelligence, and certainly the development of agents as well. We categorize attention structures of Transform…

cs.CV2026

Debunking Grad-ECLIP: A Comprehensive Study on Its Incorrectness and Fundamental Principles for Model Interpretation

Yongjin Cui, Xiaohui Fan

Grad-ECLIP is published at ICML 2024 and represents a new Transformer interpretation technical route (intermediate features-based). First, this paper demonstrates that the intermed…

cs.AI2026

Transformer Interpretability from Perspective of Attention and Gradient

Yongjin Cui, Xiaohui Fan, Huajun Chen

Although researchers' attention is more focused on the performance of Transformer models, the interpretation of Transformer can never be ignored. Gradient is widely utilized in Tra…

cs.CV2026

The Neglected Baseline in Model Interpretation

Yongjin Cui, Xiaohui Fan

We observe that existing model interpretation methods generally ignore the baseline, and such neglect often results in imprecise or even incorrect interpretation. In this paper, we…

cs.CL2025★ 1 cited

A Multi-Modal AI Copilot for Single-Cell Analysis with Instruction Following

Yin Fang, Xinle Deng, Kangwei Liu +5

Large language models excel at interpreting complex natural language instructions, enabling them to perform a wide range of tasks. In the life sciences, single-cell RNA sequencing…

cs.CL2024★ 2 cited

ChatCell: Facilitating Single-Cell Analysis with Natural Language

Yin Fang, Kangwei Liu, Ningyu Zhang +7

As Large Language Models (LLMs) rapidly evolve, their influence in science is becoming increasingly prominent. The emerging capabilities of LLMs in task generalization and free-for…

cs.CL2024★ 34 cited

Scientific Large Language Models: A Survey on Biological & Chemical Domains

Qiang Zhang, Keyang Ding, Tianwen Lyv +22

Large Language Models (LLMs) have emerged as a transformative power in enhancing natural language comprehension, representing a significant stride toward artificial general intelli…

q-bio.QM2023★ 40 cited

Mol-Instructions: A Large-Scale Biomolecular Instruction Dataset for Large Language Models

Yin Fang, Xiaozhuan Liang, Ningyu Zhang +5

Large Language Models (LLMs), with their remarkable task-handling capabilities and innovative outputs, have catalyzed significant advancements across a spectrum of fields. However,…

cs.LG2023★ 17 cited

Domain-Agnostic Molecular Generation with Chemical Feedback

Yin Fang, Ningyu Zhang, Zhuo Chen +3

The generation of molecules with desired properties has become increasingly popular, revolutionizing the way scientists design molecular structures and providing valuable support f…

cs.LG2022★ 2 cited

Knowledge-informed Molecular Learning: A Survey on Paradigm Transfer

Yin Fang, Zhuo Chen, Xiaohui Fan +1

Machine learning, notably deep learning, has significantly propelled molecular investigations within the biochemical sphere. Traditionally, modeling for such research has centered…

cs.LG2021★ 2 cited

Molecular Contrastive Learning with Chemical Element Knowledge Graph

Yin Fang, Qiang Zhang, Haihong Yang +7

Molecular representation learning contributes to multiple downstream tasks such as molecular property prediction and drug design. To properly represent molecules, graph contrastive…