𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Helix nucleation kinetics from molecular simulations in explicit solvent

✍ Scribed by Gerhard Hummer; Angel E. García; Shekhar Garde

Publisher
John Wiley and Sons
Year
2000
Tongue
English
Weight
272 KB
Volume
42
Category
Article
ISSN
0887-3585

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Mixed monte carlo/molecular dynamics sim
Mixed monte carlo/molecular dynamics simulations in explicit solvent
✍ André A. S. T. Ribeiro; Ricardo B. de Alencastro 📂 Article 📅 2012 🏛 John Wiley and Sons 🌐 English ⚖ 953 KB

## Abstract A mixed Monte Carlo/Molecular Dynamics method using the trial moves for peptide backbone sampling known as Concerted Rotations with Angles was implemented. The algorithm was used to study polyalanine systems. Equivalent results to conventional Molecular Dynamics were obtained for simula

Molecular Dynamics Studies of the Kineti
Molecular Dynamics Studies of the Kinetics of Phase Changes in Clusters II: Crystal Nucleation from Molten (RbCl)256 and (RbCl)500 Clusters
✍ Meihua Ma; Wenqing Lu; Jinfan Huang 📂 Article 📅 2002 🏛 Elsevier Science 🌐 English ⚖ 265 KB

Molecular dynamics computer simulations have been carried out to study the e4ects of cluster size and temperature on the nucleation rate of rubidium chloride clusters in the temperature range of 500+650 K. Clusters with 256 and 500 RbCl molecules have been studied and the results are compared with t

Molecular Dynamics Studies of the Kineti
Molecular Dynamics Studies of the Kinetics of Phase Changes in Clusters IV: Crystal Nucleation from Molten (NaCl)256 and (NaCl)500 Clusters
✍ Xiao-Hua Li; Jin-Fan Huang 📂 Article 📅 2010 🏛 John Wiley and Sons 🌐 English ⚖ 894 KB

## Abstract Molecular dynamics computer simulation based on the Born‐Mayer‐Huggins potential function has been carried out to study the effects of cluster size and temperature on the nucleation rate of sodium chloride clusters in the temperature range of 580 K to 630 K. Clusters with 256 and 500 Na