Chenru Duan

Chenru Duan

Massachusetts Institute of Technology - Cambridge / United States
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1424375
person_outline Chenru Duan's MOST POPULAR ARTICLES
1-) Computational discovery of transition-metal complexes: from high-throughput screening to machine learning Chemical reviews 121 (16), 9927-10000, 2021
2-) A quantitative uncertainty metric controls error in neural network-driven chemical discovery Chemical science 10 (34), 7913-7922, 2019
3-) Accurate multiobjective design in a space of millions of transition metal complexes with neural-network-driven efficient global optimization ACS central science 6 (4), 513-524, 2020
4-) Strategies and software for machine learning accelerated discovery in transition metal chemistry Industrial & Engineering Chemistry Research 57 (42), 13973-13986, 2018
5-) Using machine learning and data mining to leverage community knowledge for the engineering of stable metal–organic frameworks Journal of the American Chemical Society 143 (42), 17535-17547, 2021