Mpict New
Solvation What is the role of solvation Models for solvation Models for protein environments =72 Need a solvent to model a zwitterion!
1 Lecture 3 1.The Debye theory. Gases and polar molecules in non-polar solvent. 2.The reaction field of a non-polarizable point dipole 3.The internal and.
COST P9 Radiation Damage in Biomolecular Systems Working Group 4 Theoretical developments for radiation damages.
TUTORIAL N 2 – QUASISTATIC DIPOLES 2.1 Brownian motion2.1 Brownian motion 2.2 Einstein’s theory of Brownian motion2.2 Einstein’s theory of Brownian motion.
Thermodynamics of Dielectric Relaxations in Complex Systems TUTORIAL 3.
ß-heptapeptide CC CC CC MD: rmsd 0.14 Å NMR structure (3 1 Helix) Reversibly folds on 10 -20 ns time scale (X. Daura et al.) 7 residues, in methanol.
ß-heptapeptide
