1. Collaborative Innovation Center of Atmospheric Environment and Equipment Technology, Jiangsu Key Laboratory of Atmospheric Environment Monitoring and Pollution Control, School of Chemistry and Materials Science, Nanjing University of Information Science and Technology, Nanjing 210044, P. R. China
2. Computer Aided Drug Discovery Center, Zhuhai Institute of Advanced Technology, Chinese Academy of Sciences, Zhuhai 519003, China
3. Chemistry, School of Natural Sciences, University of Hull, Hull HU6 7RX, UK