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20232026
most citedChemist-X: Large Language Model-empowered Agent for Reaction Condition Recommendation in Chemical Synthesis

10 citations · 35 across the 39 of their papers we have counts for

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Showing 2025Show all

15 papers · 1 filter

q-bio.BM2025

CONFIDE: Hallucination Assessment for Reliable Biomolecular Structure Prediction and Design

Zijun Gao, Mutian He, Shijia Sun +8

Reliable evaluation of protein structure predictions remains challenging, as metrics like pLDDT capture energetic stability but often miss subtle errors such as atomic clashes or c…

cs.AI2025

Boosting In-Silicon Directed Evolution with Fine-Tuned Protein Language Model and Tree Search

Yaodong Yang, Yang Wang, Jinpeng Li +4

Protein evolution through amino acid mutations is a cornerstone of life sciences. Recent advances in protein language models have shown rich evolutionary patterns, offering unprece…

cs.AI2025

Lost in Tokenization: Context as the Key to Unlocking Biomolecular Understanding in Scientific LLMs

Kai Zhuang, Jiawei Zhang, Yumou Liu +10

Scientific Large Language Models (Sci-LLMs) have emerged as a promising frontier for accelerating biological discovery. However, these models face a fundamental challenge when proc…

q-bio.BM2025★ 3 cited

ODesign: A World Model for Biomolecular Interaction Design

Odin Zhang, Xujun Zhang, Haitao Lin +34

Biomolecular interactions underpin almost all biological processes, and their rational design is central to programming new biological functions. Generative AI models have emerged…

q-bio.BM2025

RiboPO: Preference Optimization for Structure- and Stability-Aware RNA Design

Minghao Sun, Hanqun Cao, Zhou Zhang +10

Designing RNA sequences that reliably adopt specified three-dimensional structures while maintaining thermodynamic stability remains challenging for synthetic biology and therapeut…

cs.CV2025

REAR: Rethinking Visual Autoregressive Models via Generator-Tokenizer Consistency Regularization

Qiyuan He, Yicong Li, Haotian Ye +6

Visual autoregressive (AR) generation offers a promising path toward unifying vision and language models, yet its performance remains suboptimal against diffusion models. Prior wor…

q-bio.QM2025★ 1 cited

InstructPLM-mu: 1-Hour Fine-Tuning of ESM2 Beats ESM3 in Protein Mutation Predictions

Junde Xu, Yapin Shi, Lijun Lang +5

Multimodal protein language models deliver strong performance on mutation-effect prediction, but training such models from scratch demands substantial computational resources. In t…

cs.CL2025

KnowGuard: Knowledge-Driven Abstention for Multi-Round Clinical Reasoning

Xilin Dang, Kexin Chen, Xiaorui Su +7

In clinical practice, physicians refrain from making decisions when patient information is insufficient. This behavior, known as abstention, is a critical safety mechanism preventi…

cs.LG2025★ 1 cited

A deep reinforcement learning platform for antibiotic discovery

Hanqun Cao, Marcelo D. T. Torres, Jingjie Zhang +8

Antimicrobial resistance (AMR) is projected to cause up to 10 million deaths annually by 2050, underscoring the urgent need for new antibiotics. Here we present ApexAmphion, a deep…

cs.CV2025

MME-Emotion: A Holistic Evaluation Benchmark for Emotional Intelligence in Multimodal Large Language Models

Fan Zhang, Zebang Cheng, Chong Deng +18

Recent advances in multimodal large language models (MLLMs) have catalyzed transformative progress in affective computing, enabling models to exhibit emergent emotional intelligenc…

cs.LG2025★ 1 cited

Lightweight MSA Design Advances Protein Folding From Evolutionary Embeddings

Hanqun Cao, Xinyi Zhou, Zijun Gao +7

Protein structure prediction often hinges on multiple sequence alignments (MSAs), which underperform on low-homology and orphan proteins. We introduce PLAME, a lightweight MSA desi…

cs.LG2025

Protein Inverse Folding From Structure Feedback

Junde Xu, Zijun Gao, Xinyi Zhou +6

The inverse folding problem, aiming to design amino acid sequences that fold into desired three-dimensional structures, is pivotal for various biotechnological applications. Here,…

q-bio.QM2025★ 1 cited

CellVerse: Do Large Language Models Really Understand Cell Biology?

Fan Zhang, Tianyu Liu, Zhihong Zhu +7

Recent studies have demonstrated the feasibility of modeling single-cell data as natural languages and the potential of leveraging powerful large language models (LLMs) for underst…

cs.CL2025★ 1 cited

The Dual-use Dilemma in LLMs: Do Empowering Ethical Capacities Make a Degraded Utility?

Yiyi Zhang, Xingyu Chen, Kexin Chen +3

Recent years have witnessed extensive efforts to enhance Large Language Models (LLMs) across various domains, alongside growing attention to their ethical implications. However, a…

cs.MA2025

Dual Ensembled Multiagent Q-Learning with Hypernet Regularizer

Yaodong Yang, Guangyong Chen, Hongyao Tang +3

Overestimation in single-agent reinforcement learning has been extensively studied. In contrast, overestimation in the multiagent setting has received comparatively little attentio…