𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Molecular Mechanics: The Conjugate Nitro Group Parameters in the MM2 Force Field

✍ Scribed by Jean-Philippe Rameau; Jean Devillers


Book ID
106240717
Publisher
Springer-Verlag
Year
1996
Tongue
English
Weight
226 KB
Volume
3
Category
Article
ISSN
1610-2940

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


The tetracycline: Mg2+ complex: A molecu
✍ Alexey Aleksandrov; Thomas Simonson πŸ“‚ Article πŸ“… 2006 πŸ› John Wiley and Sons 🌐 English βš– 686 KB

## Abstract Tetracycline (Tc) is an important antibiotic, which binds specifically to the ribosome and several proteins, in the form of a Tc^–^:Mg^2+^ complex. To model Tc:protein and Tc:RNA interactions, we have developed a molecular mechanics force field model of Tc, which is consistent with the

Molecular mechanics (MM2) and conformati
✍ Berta FernΓ‘ndez; Miguel A. RΓ­os; LuΓ­s Carballeira πŸ“‚ Article πŸ“… 1991 πŸ› John Wiley and Sons 🌐 English βš– 824 KB

A molecular mechanics force field was developed for systems bearing the N -C -0 unit on the basis of 6-31G\* and 4-21G %b initio" calculations with full optimization of the geometry and experimental heats of formation. The parameters used, which implicitly included the anomeric effect, provided good