A Survey of Large Language Models for Text-Guided Molecular Discovery: from Molecule Generation to Optimization

A Survey of Large Language Models for Text-Guided Molecular Discovery: from Molecule Generation to Optimization

22 May 2025

Abhishek Pandey

Papers citing "A Survey of Large Language Models for Text-Guided Molecular Discovery: from Molecule Generation to Optimization"

12 / 12 papers shown

Title
ReTool: Reinforcement Learning for Strategic Tool Use in LLMs Jiazhan Feng Shijue Huang Xingwei Qu Ge Zhang Yujia Qin Baoquan Zhong Chengquan Jiang Jinxin Chi Wanjun Zhong OffRL ReLM SyDa KELM LRM 98 19 0 15 Apr 2025
Reasoning Models Can Be Effective Without Thinking Wenjie Ma Jingxuan He Charlie Snell Tyler Griggs Sewon Min Matei A. Zaharia ReLM LRM 82 36 1 14 Apr 2025
Collaborative Expert LLMs Guided Multi-Objective Molecular Optimization Jiajun Yu Y. Zheng Huan Yee Koh Xiaojun Jia Tianyue Wang Haishuai Wang 77 2 0 05 Mar 2025
MOLLM: Multi-Objective Large Language Model for Molecular Design -- Optimizing with Experts Nian Ran Yue Wang Richard Allmendinger 102 1 0 18 Feb 2025
ControllableGPT: A Ground-Up Designed Controllable GPT for Molecule Optimization Xuefeng Liu Songhao Jiang Yangqiu Song Rick L. Stevens BDL 39 1 0 15 Feb 2025
Deep Lead Optimization: Leveraging Generative AI for Structural Modification Odin Zhang Haitao Lin Hui Zhang Huifeng Zhao Yufei Huang Yuansheng Huang Dejun Jiang Chang-Yu Hsieh P. Pan Tingjun Hou 65 8 0 30 Apr 2024
Large Language Models are In-Context Molecule Learners Jiatong Li Wei Liu Zhihao Ding Wenqi Fan Yuqiang Li Qing Li 77 6 0 07 Mar 2024
LoRA: Low-Rank Adaptation of Large Language Models J. E. Hu Yelong Shen Phillip Wallis Zeyuan Allen-Zhu Yuanzhi Li Shean Wang Lu Wang Weizhu Chen OffRL AI4TS AI4CE ALM AIMat 188 9,946 0 17 Jun 2021
Language Models are Few-Shot Learners Tom B. Brown Benjamin Mann Nick Ryder Melanie Subbiah Jared Kaplan ... Christopher Berner Sam McCandlish Alec Radford Ilya Sutskever Dario Amodei BDL 432 41,106 0 28 May 2020
Open Graph Benchmark: Datasets for Machine Learning on Graphs Weihua Hu Matthias Fey Marinka Zitnik Yuxiao Dong Hongyu Ren Bowen Liu Michele Catasta J. Leskovec 173 2,687 0 02 May 2020
BERT: Pre-training of Deep Bidirectional Transformers for Language Understanding Jacob Devlin Ming-Wei Chang Kenton Lee Kristina Toutanova VLM SSL SSeg 853 93,936 0 11 Oct 2018
SQuAD: 100,000+ Questions for Machine Comprehension of Text Pranav Rajpurkar Jian Zhang Konstantin Lopyrev Percy Liang RALM 123 8,067 0 16 Jun 2016