Folder contains data from umbrella sampling simulations which is used to make histogram analysis and free energy map.
(COLVAR files cut to 10 ps length and 1 ps from simulation discarded as equilibration) 
TS1 (2->3)
-------------
makehist.plumed: plumed input for histogram generation 
metadata-270121.dat: wham input for computing free energy

US-1.09861-10000:
COLVAR-US-1.09861-10000
HISTOGRAM
plumed.dat

US-1.115079-10000:
COLVAR-US-1.115079-10000
HISTOGRAM
plumed.dat

US-1.140812-10000:
COLVAR-US-1.140812-10000
HISTOGRAM
plumed.dat

US-1.164734-10000:
COLVAR-US-1.164734-10000
HISTOGRAM
plumed.dat

US-1.194206-10000:
COLVAR-US-1.194206-10000
HISTOGRAM
plumed.dat

US-1.216784-10000:
COLVAR-US-1.216784-10000
HISTOGRAM
plumed.dat

US-1.241396-10000:
COLVAR-US-1.241396-10000
HISTOGRAM
plumed.dat

US-1.264654-10000:
COLVAR-US-1.264654-10000
HISTOGRAM
plumed.dat

US-1.290043-10000:
COLVAR-US-1.290043-10000
HISTOGRAM
plumed.dat

US-1.318173-10000:
COLVAR-US-1.318173-10000
HISTOGRAM
plumed.dat

US-1.339858-10000:
COLVAR-US-1.339858-10000
HISTOGRAM
plumed.dat

US-1.365765-10000:
COLVAR-US-1.365765-10000
HISTOGRAM
plumed.dat

US-1.39017-10000:
COLVAR-US-1.39017-10000
HISTOGRAM
plumed.dat

US-1.412844-10000:
COLVAR-US-1.412844-10000
HISTOGRAM
plumed.dat

US-1.441747-10000:
COLVAR-US-1.441747-10000
HISTOGRAM
plumed.dat

US-1.468682-10000:
COLVAR-US-1.468682-10000
HISTOGRAM
plumed.dat

US-1.491641-10000:
COLVAR-US-1.491641-10000
HISTOGRAM
plumed.dat

US-1.515103-10000:
COLVAR-US-1.515103-10000
HISTOGRAM
plumed.dat

US-1.544444-10000:
COLVAR-US-1.544444-10000
HISTOGRAM
plumed.dat

US-1.558883-10000:
COLVAR-US-1.558883-10000
HISTOGRAM
plumed.dat

US-1.590557-10000:
COLVAR-US-1.590557-10000
HISTOGRAM
plumed.dat

US-1.620826-10000:
COLVAR-US-1.620826-10000
HISTOGRAM
plumed.dat

US-1.645467-10000:
COLVAR-US-1.645467-10000
HISTOGRAM
plumed.dat

US-1.665986-10000:
COLVAR-US-1.665986-10000
HISTOGRAM
plumed.dat

US-1.691689-10000:
COLVAR-US-1.691689-10000
HISTOGRAM
plumed.dat

US-1.716245-10000:
COLVAR-US-1.716245-10000
HISTOGRAM
plumed.dat

US-1.741642-10000:
COLVAR-US-1.741642-10000
HISTOGRAM
plumed.dat

US-1.767181-10000:
COLVAR-US-1.767181-10000
HISTOGRAM
plumed.dat

US-1.790163-10000:
COLVAR-US-1.790163-10000
HISTOGRAM
plumed.dat

US-1.813886-10000:
COLVAR-US-1.813886-10000
HISTOGRAM
plumed.dat

US-1.840935-10000:
COLVAR-US-1.840935-10000
HISTOGRAM
plumed.dat

US-1.864024-10000:
COLVAR-US-1.864024-10000
HISTOGRAM
plumed.dat

US-1.890562-10000:
COLVAR-US-1.890562-10000
HISTOGRAM
plumed.dat

US-1.901316-10000:
COLVAR-US-1.901316-10000
HISTOGRAM
plumed.dat
