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Junqi Yin

national center for computational sciences, oak ridge national laboratory

23H-index
156Paper Count
2.4KCitation Count
Published Papers 26
Publication Date
Sequence length scaling in vision transformers for scientific images on frontier
err2025-11-19
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PREAI
errAristeidis Tsaris; Chengming Zhang; Xiao Wang; Junqi Yin; Siyan Liu; Moetasim Ashfaq; Ming Fan; Jong Youl Choi; Mohamed Wahib; Dan Lu; Prasanna Balaprakash; Feiyi Wang
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Designing complex concentrated alloys with quantum machine learning and language modeling
errMATTER
IF17.5
err2024-10-01
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PREAI
errPei, Zongrui; Gong, Yilun; Liu, Xianglin; Yin, Junqi
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Towards the holistic design of alloys with large language models
err2024-09-12
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PREAI
errPei, Zongrui; Yin, Junqi; Neugebauer, Joerg; Jain, Anubhav
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Toward the design of ultrahigh-entropy alloys via mining six million texts (vol 14, 54, 2023)
err2023-06-16
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errOAAI
errPei, Zongrui; Yin, Junqi; Liaw, Peter. K. K.; Raabe, Dierk
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Toward the design of ultrahigh-entropy alloys via mining six million texts
err2023-01-04
err36
errOAAI
errPei, Zongrui; Yin, Junqi; Liaw, Peter K.; Raabe, Dierk
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Atomic structure generation from reconstructing structural fingerprints
err2022-11-25
err8
errOAAI
errFung, Victor; Jia, Shuyi; Zhang, Jiaxin; Bi, Sirui; Yin, Junqi; Ganesh, P.
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Language models for the prediction of SARS-CoV-2 inhibitors
err2022-10-07
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errOAAI
errBlanchard, Andrew E.; Gounley, John; Bhowmik, Debsindhu; Shekar, Mayanka Chandra; Lyngaas, Isaac; Gao, Shang; Yin, Junqi; Tsaris, Aristeidis; Wang, Feiyi; Glaser, Jens
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Eutectic-reaction brazing of Al0.3CoCrFeNi high-entropy alloys using Ni/Nb/Ni interlayers
err2022-09-01
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PREAI
errLei, Y.; Sun, J.; Song, X. G.; Yang, M. X.; Yang, T. L.; Yin, J.
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Intelligent resolution: Integrating Cryo-EM with AI-driven multi-resolution simulations to observe the severe acute respiratory syndrome coronavirus-2 replication-transcription machinery in action
err2022-08-05
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errOAAI
errTrifan, Anda; Gorgun, Defne; Salim, Michael; Li, Zongyi; Brace, Alexander; Zvyagin, Maxim; Ma, Heng; Clyde, Austin; Clark, David; Hardy, David J.; Burnley, Tom; Huang, Lei; McCalpin, John; Emani, Murali; Yoo, Hyenseung; Yin, Junqi; Tsaris, Aristeidis; Subbiah, Vishal; Raza, Tanveer; Liu, Jessica; Trebesch, Noah; Wells, Geoffrey; Mysore, Venkatesh; Gibbs, Thomas; Phillips, James; Chennubhotla, S. Chakra; Foster, Ian; Stevens, Rick; Anandkumar, Anima; Vishwanath, Venkatram; Stone, John E.; Tajkhorshid, Emad; Harris, Sarah A.; Ramanathan, Arvind
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The Role of Hydrophobic Nodes in the Dynamics of Class A β-Lactamases
err2021-09-21
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errOAAI
errOlehnovics, Edgar; Yin, Junqi; Perez, Adria; De Fabritiis, Gianni; Bonomo, Robert A.; Bhowmik, Debsindhu; Haider, Shozeb
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Inter-Subunit Dynamics Controls Tunnel Formation During the Oxygenation Process in Hemocyanin Hexamers
err2021-09-15
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errOAAI
errBux, Khair; Shen, Xiayu; Tariq, Muhammad; Yin, Junqi; Moin, Syed Tarique; Bhowmik, Debsindhu; Haider, Shozeb
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Dynamic Profiling of β-Coronavirus 3CL Mpro Protease Ligand-Binding Sites
err2021-06-14
err38
errOAAI
errCho, Eunice; Rosa, Margarida; Anjum, Ruhi; Mehmood, Saman; Soban, Mariya; Mujtaba, Moniza; Bux, Khair; Moin, Syed T.; Tanweer, Mohammad; Dantu, Sarath; Pandini, Alessandro; Yin, Junqi; Ma, Heng; Ramanathan, Arvind; Islam, Barira; Mey, Antonia S. J. S.; Bhowmik, Debsindhu; Haider, Shozeb
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Geometrical-Based Generative Adversarial Network to Enhance Digital Rock Image Quality
err2021-06-14
err9
errOAAI
errNiu, Yufu; Da Wang, Ying; Mostaghimi, Peyman; McClure, James E.; Yin, Junqi; Armstrong, Ryan T.
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Monte Carlo simulation of order-disorder transition in refractory high entropy alloys: A data-driven approach
err2021-02-01
err52
errOAAI
errLiu, Xianglin; Zhang, Jiaxin; Yin, Junqi; Bi, Sirui; Eisenbach, Markus; Wang, Yang
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Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19
err2020-12-16
err130
errOAAI
errAcharya, A.; Agarwal, R.; Baker, M. B.; Baudry, J.; Bhowmik, D.; Boehm, S.; Byler, K. G.; Chen, S. Y.; Coates, L.; Cooper, C. J.; Demerdash, O.; Daidone, I; Eblen, J. D.; Ellingson, S.; Forli, S.; Glaser, J.; Gumbart, J. C.; Gunnels, J.; Hernandez, O.; Irle, S.; Kneller, D. W.; Kovalevsky, A.; Larkin, J.; Lawrence, T. J.; LeGrand, S.; Liu, S-H; Mitchell, J. C.; Park, G.; Parks, J. M.; Pavlova, A.; Petridis, L.; Poole, D.; Pouchard, L.; Ramanathan, A.; Rogers, D. M.; Santos-Martins, D.; Scheinberg, A.; Sedova, A.; Shen, Y.; Smith, J. C.; Smith, M. D.; Soto, C.; Tsaris, A.; Thavappiragasam, M.; Tillack, A. F.; Vermaas, J. V.; Vuong, V. Q.; Yin, J.; Yoo, S.; Zahran, M.; Zanetti-Polzi, L.
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Machine-learning informed prediction of high-entropy solid solution formation: Beyond the Hume-Rothery rules
err2020-05-07
err144
errOAAI
errPei, Zongrui; Yin, Junqi; Hawk, Jeffrey A.; Alman, David E.; Gao, Michael C.
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Robust data-driven approach for predicting the configurational energy of high entropy alloys
err2020-01-01
err61
errOAAI
errZhang, Jiaxin; Liu, Xianglin; Bi, Sirui; Yin, Junqi; Zhang, Guannan; Eisenbach, Markus
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