Rationale
This workshop is designed to provide participants with a comprehensive understanding of molecular dynamics simulations, the use of the Gromacs software, and its application in simulating biomembranes. Participants will gain know-how in setting up and running simulations, analyzing results, and interpreting biomembrane dynamics.
Syllabus
- GROMACS Overview
- Introduction to molecular dynamics (MD)
- Force fields in MD
- MD Simulations with Gromacs
- MD Trajectories
- Advanced Topics in MD Simulations
- Biomembrane structure and composition
- Case studies and research Applications