学者信息

PAVLO OLEKSANDROVYCH DRAL

化学化工学院

合作者

已发表成果:

WOK 论文 47 篇;其它论文 1 篇;图书及章节 2 本;

  • Artificial intelligence-enhanced quantum chemical method with broad applicability

    NATURE COMMUNICATIONS,,2021-12-02.
    Zheng, Peikun; Zubatyuk, Roman; Wu, Wei; Isayev, Olexandr; Dral, Pavlo O.
    WOS:000727618000005   10.1038/s41467-021-27340-2
    收录情况:SCIE
  • Choosing the right molecular machine learning potential

    Chemical Science,2041-6520,2021-11-21.
    Pinheiro, Max, Jr.; Ge, Fuchun; Ferre, Nicolas; Dral, Pavlo O.; Barbatti, Mario
    WOS:000698748000001   EI:20214611162094   10.1039/d1sc03564a
    收录情况:SCIE、EI
  • Speeding up quantum dissipative dynamics of open systems with kernel methods

    New Journal of Physics,1367-2630,2021-11.
    Ullah, Arif; Dral, Pavlo O.
    WOS:000716733700001   EI:20214811229913   10.1088/1367-2630/ac3261
    收录情况:SCIE、EI
  • MLatom 2: An Integrative Platform for Atomistic Machine Learning

    TOPICS IN CURRENT CHEMISTRY,2365-0869,2021-08.
    Dral, Pavlo O.; Ge, Fuchun; Xue, Bao-Xin; Hou, Yi-Fan; Pinheiro, Max, Jr.; Huang, Jianxing; Barbatt...
    WOS:000659201700002   10.1007/s41061-021-00339-5
    收录情况:SCIE
  • Molecular excited states through a machine learning lens

    NATURE REVIEWS CHEMISTRY,,2021-06.
    Dral, Pavlo O.; Barbatti, Mario
    WOS:000652426900001   10.1038/s41570-021-00278-1
    收录情况:SCIE