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Pavlo O Dral

Pavlo O Dral

Xiamen University - Xiamen / China
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 701516
厦门大学
person_outline Pavlo O Dral's MOST POPULAR ARTICLES
1-) Quantum chemistry structures and properties of 134 kilo molecules Scientific data 1, 140022, 2014
2-) Big Data Meets Quantum Chemistry Approximations: The Δ-Machine Learning Approach Journal of Chemical Theory and Computation 11 (5), 2087-2096, 2015
3-) Quantum Chemistry in the Age of Machine Learning The Journal of Physical Chemistry Letters 11 (6), 2336-2347, 2020
4-) Molecular excited states through a machine learning lens Nature Reviews Chemistry 5 (6), 388-405, 2021
5-) Choosing the right molecular machine learning potential Chemical Science, 2021