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Eunjae Shim
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Predicting reaction conditions from limited data through active transfer learning
E Shim, JA Kammeraad, Z Xu, A Tewari, T Cernak, PM Zimmerman
Chemical Science 13 (22), 6655-6668, 2022
322022
Reinforcing the supply chain of umifenovir and other antiviral drugs with retrosynthetic software
Y Lin, Z Zhang, B Mahjour, D Wang, R Zhang, E Shim, A McGrath, Y Shen, ...
Nature Communications 12 (1), 7327, 2021
23*2021
Formal Cross-Coupling of Amines and Carboxylic Acids to Form sp3–sp2 Carbon–Carbon Bonds
JL Douthwaite, R Zhao, E Shim, B Mahjour, P Zimmerman, T CERNAK
Journal of the American Chemical Society 145 (20), 10930-10937, 2023
202023
Machine learning strategies for reaction development: Toward the low-data limit
E Shim, A Tewari, T Cernak, PM Zimmerman
Journal of Chemical Information and Modeling 63 (12), 3659-3668, 2023
62023
Stereoselective α-Tertiary Alkylation of N-(Arylacetyl) oxazolidinones
E Shim, A Zakarian
Synlett 31 (07), 683-686, 2020
52020
Adaptive sampling for discovery
Z Xu, E Shim, A Tewari, P Zimmerman
Advances in Neural Information Processing Systems 35, 1114-1126, 2022
22022
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