This directory contains several supplemental tools for ORAC

  orac-post-out: a script to produce a t-vs-property file from an ORAC output

Directories:

  analysis	process a trajectory PDB file to output one or more Collective Variables (CV)
  bennett
  dcd2pdb       expand a DCD trajectory file to PDB form
  hist2d 	create population histogram of 2D points {x,y}
  MBAR          compute reweighting factors for a multi-ensemble simulation
  metafes
  rmsd90        compute RMSD between structures from one or more PDB files
  xyz2pdb       expand an .xyz trajectory file to PDB form


In each directory:

  - type "make" to compile

  - type "make test" to process sample data 

