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2010.15166
Cited By
Polymer Informatics with Multi-Task Learning
28 October 2020
Christopher Künneth
Arunkumar Chitteth Rajan
Huan Tran
Lihua Chen
Chiho Kim
R. Ramprasad
AI4CE
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Papers citing
"Polymer Informatics with Multi-Task Learning"
19 / 19 papers shown
Graph Diffusion Transformers are In-Context Molecular Designers
Gang Liu
Jie Chen
Yihan Zhu
Michael Sun
Tengfei Luo
Nitesh Chawla
Meng Jiang
DiffM
AI4CE
149
2
0
09 Oct 2025
What do Large Language Models know about materials?
Adrian Ehrenhofer
Thomas Wallmersperger
Gianaurelio Cuniberti
54
1
0
19 Jul 2025
Data Fusion of Deep Learned Molecular Embeddings for Property Prediction
Journal of Chemical Information and Modeling (JCIM), 2025
Robert Appleton
Brian C Barnes
Alejandro Strachan
FedML
AI4CE
320
1
0
09 Apr 2025
Multimodal machine learning with large language embedding model for polymer property prediction
Chemistry of Materials (Chem. Mater.), 2025
Tianren Zhang
Dai-Bei Yang
516
11
0
29 Mar 2025
High-entropy Advantage in Neural Networks' Generalizability
Entao Yang
Wei Wei
Yue Shang
Ge Zhang
AI4CE
495
2
0
17 Mar 2025
AI-Driven Discovery of High Performance Polymer Electrodes for Next-Generation Batteries
Journal of Polymer Science (J. Polym. Sci.), 2025
Subhash V.S. Ganti
Lukas Woelfel
Christopher Kuenneth
500
7
0
20 Feb 2025
From Abstract to Actionable: Pairwise Shapley Values for Explainable AI
Jiaxin Xu
Hung Chau
Angela Burden
TDI
474
2
0
18 Feb 2025
Molecular topological deep learning for polymer property prediction
Cong Shen
Yipeng Zhang
Fei Han
Kelin Xia
AI4CE
288
5
0
07 Oct 2024
Multi-Task Multi-Fidelity Learning of Properties for Energetic Materials
Propellants, explosives, pyrotechnics (PEP), 2024
Robert Appleton
Daniel J. Klinger
Brian H. Lee
Michael Taylor
Sohee Kim
Samuel Blankenship
Brian C Barnes
Steven F. Son
Alejandro Strachan
275
6
0
21 Aug 2024
PolyCL: Contrastive Learning for Polymer Representation Learning via Explicit and Implicit Augmentations
Digital Discovery (DD), 2024
Jiajun Zhou
Yijie Yang
Austin M. Mroz
Kim E. Jelfs
SSL
276
7
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
264
3
0
09 Jul 2024
MMPolymer: A Multimodal Multitask Pretraining Framework for Polymer Property Prediction
International Conference on Information and Knowledge Management (CIKM), 2024
Fanmeng Wang
Wentao Guo
Minjie Cheng
Shen Yuan
Hongteng Xu
Zhifeng Gao
262
0
0
07 Jun 2024
Transferring a molecular foundation model for polymer property predictions
Journal of Chemical Information and Modeling (JCIM), 2023
Pei Zhang
Logan T. Kearney
D. Bhowmik
Zachary R. Fox
Amit K. Naskar
Ravi Tandon
AI4CE
239
18
0
25 Oct 2023
Materials Informatics: An Algorithmic Design Rule
B. Bishnoi
263
1
0
05 May 2023
polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics
Nature Communications (Nat Commun), 2022
Christopher Kuenneth
R. Ramprasad
298
211
0
29 Sep 2022
TransPolymer: a Transformer-based language model for polymer property predictions
npj Computational Materials (npj Comput. Mater.), 2022
Changwen Xu
Yuyang Wang
A. Farimani
580
171
0
03 Sep 2022
Representing Polymers as Periodic Graphs with Learned Descriptors for Accurate Polymer Property Predictions
Journal of Chemical Information and Modeling (JCIM), 2022
Evan R. Antoniuk
Peggy Li
B. Kailkhura
A. Hiszpanski
214
52
0
27 May 2022
A graph representation of molecular ensembles for polymer property prediction
Chemical Science (Chem. Sci.), 2022
Matteo Aldeghi
Connor W. Coley
AI4CE
356
79
0
17 May 2022
Bioplastic Design using Multitask Deep Neural Networks
Communications Materials (Commun. Mater.), 2022
Christopher Kuenneth
Jessica Lalonde
B. Marrone
C. Iverson
R. Ramprasad
G. Pilania
AI4CE
166
46
0
22 Mar 2022
1
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