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Name		Name	Last commit message	Last commit date
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data		data
man		man
src		src
DESCRIPTION		DESCRIPTION
MD5		MD5
NAMESPACE		NAMESPACE
README		README

README

Compas: Conformational manipulations of protein atomic structures
This R package provides some useful functions for performing common operations on protein structures represented in PDB (Protein Data Bank) format.
Key features provided:
- Energy evaluation of a conformation using the DFIRE potential
- Fast RMSD calculations between two PDB conformations
- Cartesian coordinate calculations for 3-D positions of individual atoms and entire amino acid side chains