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Two Wrongs Can Make a Right: A Transfer Learning Approach for Chemical Discovery with Chemical Accuracy.

C. Duan, D. Chu, A. Nandy, and H. Kulik. CoRR, (2022)

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Linshu Duan

Mingke Duan

Junrui Duan

Qing Duan

Miyi Duan

Other publications of authors with the same name

Machine learning models predict calculation outcomes with the transferability necessary for computational catalysis.C. Duan, A. Nandy, H. Adamji, Y. Román-Leshkov, and H. Kulik. CoRR, (2022)M2Hub: Unlocking the Potential of Machine Learning for Materials Discovery.Y. Du, Y. Wang, Y. Huang, J. Li, Y. Zhu, T. Xie, C. Duan, J. Gregoire, and C. Gomes. CoRR, (2023)Machine learning to tame divergent density functional approximations: a new path to consensus materials design principles.C. Duan, S. Chen, M. Taylor, F. Liu, and H. Kulik. CoRR, (2021)Representations and Strategies for Transferable Machine Learning Models in Chemical Discovery.D. Harper, A. Nandy, N. Arunachalam, C. Duan, J. Janet, and H. Kulik. CoRR, (2021)Two Wrongs Can Make a Right: A Transfer Learning Approach for Chemical Discovery with Chemical Accuracy.C. Duan, D. Chu, A. Nandy, and H. Kulik. CoRR, (2022)MOFSimplify: Machine Learning Models with Extracted Stability Data of Three Thousand Metal-Organic Frameworks.A. Nandy, G. Terrones, N. Arunachalam, C. Duan, D. Kastner, and H. Kulik. CoRR, (2021)Symmetry-Informed Geometric Representation for Molecules, Proteins, and Crystalline Materials.S. Liu, W. Du, Y. Li, Z. Li, Z. Zheng, C. Duan, Z. Ma, O. Yaghi, A. Anandkumar, C. Borgs and 3 other author(s). CoRR, (2023)Rapid Exploration of a 32.5M Compound Chemical Space with Active Learning to Discover Density Functional Approximation Insensitive and Synthetically Accessible Transitional Metal Chromophores.C. Duan, A. Nandy, G. Terrones, D. Kastner, and H. Kulik. CoRR, (2022)Accurate transition state generation with an object-aware equivariant elementary reaction diffusion model.C. Duan, Y. Du, H. Jia, and H. Kulik. Nat. Comput. Sci., 3 (12): 1045-1055 (2023)Low-cost machine learning approach to the prediction of transition metal phosphor excited state properties.G. Terrones, C. Duan, A. Nandy, and H. Kulik. CoRR, (2022)

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Disambiguation of "Duan, Chenru"

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Two Wrongs Can Make a Right: A Transfer Learning Approach for Chemical Discovery with Chemical Accuracy.

Please choose a person to relate this publication to

Linshu Duan

Mingke Duan

Junrui Duan

Qing Duan

Miyi Duan

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Duan, Chenru"

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML Two Wrongs Can Make a Right: A Transfer Learning Approach for Chemical Discovery with Chemical Accuracy.

Please choose a person to relate this publication to

Linshu Duan

Mingke Duan

Junrui Duan

Qing Duan

Miyi Duan

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
community post
history of this post
URL
DOI
BibTeX
EndNote
APA
Chicago
DIN 1505
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Two Wrongs Can Make a Right: A Transfer Learning Approach for Chemical Discovery with Chemical Accuracy.