Affiliation: | 1. Department of Theoretical and Computational Molecular Science, Institute for Molecular Science, Okazaki, Aichi, Japan;2. Department of Functional Molecular Science, School of Physical Sciences, The Graduate University for Advanced Studies, Okazaki, Aichi, Japanyanait@ims.ac.jp;4. Graduate School of System Informatics, Kobe University, Kobe, Japan;5. Japan Science and Technology Agency, PRESTO, Kawaguchi, Saitama, Japan;6. Department of Functional Molecular Science, School of Physical Sciences, The Graduate University for Advanced Studies, Okazaki, Aichi, Japan;7. Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic, Prague, Czech Republic;8. Uppsala Centre for Computational Chemistry – UC3, and Department of Chemistry – ?ngstr?m, Uppsala University, Uppsala, Sweden;9. Department of Theoretical Chemistry, University of Lund, Lund, Sweden |