𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Molecular dynamics method for proteins with ionization-conformation coupling and equilibrium titration

✍ Scribed by Yu. N. Vorob’ev

Book ID
110174918
Publisher
SP MAIK Nauka/Interperiodica
Year
2011
Tongue
English
Weight
341 KB
Volume
45
Category
Article
ISSN
0026-8933

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Discrimination between native and intent
Discrimination between native and intentionally misfolded conformations of proteins: ES/IS, a new method for calculating conformational free energy that uses both dynamics simulations with an explicit solvent and an implicit solvent continuum model
✍ Yury N. Vorobjev; Juan Carlos Almagro; Jan Hermans 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 179 KB 👁 3 views

A new method for calculating the total conformational free energy of proteins in water solvent is presented. The method consists of a relatively brief simulation by molecular dynamics with explicit solvent (ES) molecules to produce a set of microstates of the macroscopic conformation. Conformational