## Abstract Thermal motion of CH is investigated by performing an __ab initio__ molecular dynamics method with the second‐order Møller‐Plesset (MP2)/6‐311G\*\* force field. In the trajectories obtained at 400 K, we have observed rapid interconversion behavior of the geometrical parameters of CH wit
✦ LIBER ✦
Non-additivity in cation—peptide interactions. A molecular dynamics and ab initio study of Na+ in the gramicidin channel
✍ Scribed by Benoît Roux
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 929 KB
- Volume
- 212
- Category
- Article
- ISSN
- 0009-2614
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