Modeling of CryoEM Map Workshop - Houston, Jan. 14-17, 2010
Tutorials
- Molecular Dynamics Flexible Fitting (MDFF) (html)
(pdf,
1.1M) (required tutorial files [.tar.gz,
29.7M] [.zip,
29.7M],
individual files)
This tutorial describes how to flexibly fit atomic structures into density maps using the MDFF method. This method can be used to obtain atomic models of macromolecular complexes by combining X-ray structures and cry-electron microscopy maps. Requires VMD and NAMD. Tutorial works on Windows, Mac, and Unix/Linux platforms.
- Structure Check (pdf,
628k) (required tutorial files [.tar.gz,
762k] [.zip,
753k],
individual files)
This tutorial describes two VMD plugins that can be used to detect and correct certain structure errors, namely chirality and cis peptide bonds. The plugins can also be used to prevent these errors from occuring in simulations with NAMD. Requires VMD and NAMD. Tutorial works on Windows, Mac, and Unix/Linux platforms.