Properties of water/apolar interfaces as seen from Monte Carlo simulations
✍ Scribed by Pál Jedlovszky; Árpád Vincze; George Horvai
- Book ID
- 104059392
- Publisher
- Elsevier Science
- Year
- 2004
- Tongue
- English
- Weight
- 791 KB
- Volume
- 109
- Category
- Article
- ISSN
- 0167-7322
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## Abstract We present results of off‐lattice Monte Carlo simulations of weakly charged chains where the charged beads interact with a screened Coulomb potential of Debye‐Hückel type. The behaviour of the mean square end‐to‐end distance and mean‐square radius of gyration versus chain length is disc
The ionic structure of the headgroup region of a fully hydrated dimyristoylphosphatidylcholine (DMPC) bilayer is analysed on the basis of an all-atom Monte Carlo simulation. Similar analyses are also performed on simulated configurations of 2 M aqueous o-phosphorylcholine (o-PC), and 1 M, 2 M and 3