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The Journal of Organic Chemistry
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October 3, 2024
Surprising Dynamics Phenomena in the Diels-Alder Reaction of C<sub>60</sub> Uncovered with AI
Yi-Fan Hou, Quanhao Zhang, Pavlo O Dral
Journal of Chemical Theory and Computation
|
September 12, 2024
Physics-Informed Active Learning for Accelerating Quantum Chemical Simulations
Yi-Fan Hou, Lina Zhang, Quanhao Zhang, et al.
Angewandte Chemie (International Ed. in English)
|
February 5, 2026
Photochemical N-dealkylation of Tertiary Amines Coupled With Photocharging of Poly(Heptazine Imides)
Jingru Zhuang, Quanhao Zhang, Chong Wang, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
July 3, 2026
General Synthesis of Chiral Mesostructured Carbonates Using Chiral Vicinal Polyhydroxy Molecules
Yuqiang Shi, Yuhang Tang, Rongqing Tan, et al.
Journal of Chemical Theory and Computation
|
January 25, 2024
MLatom 3: A Platform for Machine Learning-Enhanced Computational Chemistry Simulations and Workflows
Pavlo O Dral, Fuchun Ge, Yi-Fan Hou, et al.
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Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
The Journal of Organic Chemistry
|
October 3, 2024
Surprising Dynamics Phenomena in the Diels-Alder Reaction of C<sub>60</sub> Uncovered with AI
Yi-Fan Hou, Quanhao Zhang, Pavlo O Dral
Journal of Chemical Theory and Computation
|
September 12, 2024
Physics-Informed Active Learning for Accelerating Quantum Chemical Simulations
Yi-Fan Hou, Lina Zhang, Quanhao Zhang, et al.
Angewandte Chemie (International Ed. in English)
|
February 5, 2026
Photochemical N-dealkylation of Tertiary Amines Coupled With Photocharging of Poly(Heptazine Imides)
Jingru Zhuang, Quanhao Zhang, Chong Wang, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
July 3, 2026
General Synthesis of Chiral Mesostructured Carbonates Using Chiral Vicinal Polyhydroxy Molecules
Yuqiang Shi, Yuhang Tang, Rongqing Tan, et al.
Journal of Chemical Theory and Computation
|
January 25, 2024
MLatom 3: A Platform for Machine Learning-Enhanced Computational Chemistry Simulations and Workflows
Pavlo O Dral, Fuchun Ge, Yi-Fan Hou, et al.
Page
of 1