Počet záznamů: 1
The semiempirical quantum chemical PM6 method augmented by dispersion and H-bonding correction terms describes reliably various types of non-covalent complexes
- 1.Řezáč, J., Fanfrlík, J., Salahub, D., Hobza, P. The semiempirical quantum chemical PM6 method augmented by dispersion and H-bonding correction terms describes reliably various types of non-covalent complexes. Journal of Chemical Theory and Computation. 2009, 5(7), 1749-1760. ISSN 1549-9618. E-ISSN 1549-9626. Dostupné z: doi: 10.1021/ct9000922
Počet záznamů: 1