polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics

29 September 2022

Papers citing "polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics"

20 / 20 papers shown

Title
Multi-modal cascade feature transfer for polymer property prediction Kiichi Obuchi Yuta Yahagi Kiyohiko Toyama Shukichi Tanaka Kota Matsui 37 0 0 06 May 2025
PolyConf: Unlocking Polymer Conformation Generation through Hierarchical Generative Models Fanmeng Wang Wentao Guo Qi Ou Hongshuai Wang Haitao Lin Hongteng Xu Zhifeng Gao AI4CE 24 1 0 11 Apr 2025
Multimodal machine learning with large language embedding model for polymer property prediction Tianren Zhang Dai-Bei Yang 39 0 0 29 Mar 2025
Offline Model-Based Optimization: Comprehensive Review Minsu Kim Jiayao Gu Ye Yuan Taeyoung Yun Z. Liu Yoshua Bengio Can Chen OffRL 51 2 0 21 Mar 2025
Uni-3DAR: Unified 3D Generation and Understanding via Autoregression on Compressed Spatial Tokens Shuqi Lu Haowei Lin Lin Yao Zhifeng Gao Xiaohong Ji W. Elwasif Linfeng Zhang Guolin Ke 41 0 0 20 Mar 2025
Universal Semantic Embeddings of Chemical Elements for Enhanced Materials Inference and Discovery Yunze Jia Yuehui Xian Yangyang Xu Pengfei Dang Xiangdong Ding Jun Sun Yumei Zhou Dezhen Xue 53 0 0 24 Feb 2025
AI-Driven Discovery of High Performance Polymer Electrodes for Next-Generation Batteries Subhash V.S. Ganti Lukas Woelfel Christopher Kuenneth 46 0 0 20 Feb 2025
Molecular topological deep learning for polymer property prediction Cong Shen Yipeng Zhang Fei Han Kelin Xia AI4CE 21 0 0 07 Oct 2024
PolyCL: Contrastive Learning for Polymer Representation Learning via Explicit and Implicit Augmentations Jiajun Zhou Yijie Yang Austin M. Mroz Kim E. Jelfs SSL 16 1 0 14 Aug 2024
MolTRES: Improving Chemical Language Representation Learning for Molecular Property Prediction Jun-Hyung Park Yeachan Kim Mingyu Lee Hyuntae Park SangKeun Lee 30 0 0 09 Jul 2024
Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties Ning Liu S. Jafarzadeh B. Lattimer Shuna Ni Jim Lua Yue Yu AI4CE 27 1 0 03 Jul 2024
Machine Learning Based Prediction of Proton Conductivity in Metal-Organic Frameworks Seunghee Han Byeong Gwan Lee Dae Woon Lim Jihan Kim AI4CE 19 2 0 18 Jun 2024
A Comprehensive Survey of Scientific Large Language Models and Their Applications in Scientific Discovery Yu Zhang Xiusi Chen Bowen Jin Sheng Wang Shuiwang Ji Wei Wang Jiawei Han 35 17 0 16 Jun 2024
Leakage-Resilient and Carbon-Neutral Aggregation Featuring the Federated AI-enabled Critical Infrastructure Zehang Deng Ruoxi Sun Minhui Xue Sheng Wen S. Çamtepe Surya Nepal Yang Xiang 30 1 0 24 May 2024
MAGE: Model-Level Graph Neural Networks Explanations via Motif-based Graph Generation Zhaoning Yu Hongyang Gao 37 3 0 21 May 2024
Accelerating materials discovery for polymer solar cells: Data-driven insights enabled by natural language processing Pranav Shetty Aishat Adeboye Sonakshi Gupta Chao Zhang R. Ramprasad 19 5 0 29 Feb 2024
MotifPiece: A Data-Driven Approach for Effective Motif Extraction and Molecular Representation Learning Zhaoning Yu Hongyang Gao 8 1 0 24 Dec 2023
Transferring a molecular foundation model for polymer property predictions Pei Zhang Logan T. Kearney D. Bhowmik Zachary R. Fox Amit K. Naskar John P. Gounley AI4CE 20 7 0 25 Oct 2023
Chatlaw: A Multi-Agent Collaborative Legal Assistant with Knowledge Graph Enhanced Mixture-of-Experts Large Language Model Jiaxi Cui Munan Ning Zongjia Li Bohua Chen Yang Yan Hao Li Bin Ling Yonghong Tian Li-xin Yuan AILaw RALM ELM 12 102 0 28 Jun 2023
Bidirectional Generation of Structure and Properties Through a Single Molecular Foundation Model Jinho Chang Jong Chul Ye AI4CE 17 27 0 19 Nov 2022