The untarring of the archive produces a directory ./orac5.0 with the
following structure:
- ./orac5.0
- ./orac5.0/src: Contains the source code.
- ./orac5.0/RELEASE5.0/tests: contains input/output examples covering
most of the features of the program, namely
basic tests ,
REM tests ,
Metadynamics tests ,
Steered MD tests )
- ./orac5.0/RELEASE5.0/lib: contains the parameters and topology
files according to the
AMBER force field
- ./orac5.0/RELEASE5.0/pdb: contains the Protein Data Bank
format coordinate files for running the input example.
- ./orac5.0/doc : contains the manual in pdf and html format