Ability of empirical potentials (AMBER, CHARMM, CVFF, OPLS, Poltev) and semi-empirical quantum chemical methods (AM1, MNDO/M, PM3) to describe H-bonding in DNA base pairs; comparison with ab initio results
1996; Elsevier BV; Volume: 257; Issue: 1-2 Linguagem: Inglês
10.1016/0009-2614(96)00537-4
ISSN1873-4448
AutoresPavel Hobza, František Hubálek, Martin Kabeláč, Petr Mejzlík, Jiřı́ Šponer, Jiřı́ Vondrášek,
Tópico(s)Protein Structure and Dynamics
Referência(s)