Folder contains set up and production runs for umbrella sampling simulations of TS3 (2->16)

All US* folders correspond to an umbrella sampling window simulation. First value in title corresponds to an s value and second to the force constant used in simulations.


US-1.099055-9000:
input

US-1.114885-9000:
input

US-1.140864-9000:
input

US-1.165709-9000:
input

US-1.190247-9000:
input

US-1.215514-9000:
input

US-1.22-12000:
input

US-1.240262-9000:
input

US-1.264373-9000:
input

US-1.290594-9000:
input

US-1.316726-9000:
input

US-1.340355-9000:
input

US-1.36636-9000:
input

US-1.390862-9000:
input

US-1.411378-9000:
input

US-1.443877-9000:
input

US-1.465462-9000:
input

US-1.493829-9000:
input

US-1.51624-9000:
input

US-1.541712-9000:
input

US-1.56708-9000:
input

US-1.590553-9000:
input

US-1.61566-9000:
input

US-1.638557-9000:
input

US-1.661539-9000:
input

US-1.690304-9000:
input

US-1.715713-9000:
input

US-1.738821-9000:
input

US-1.76412-9000:
input

US-1.792657-12000:
input

US-1.792657-9000:
input

US-1.803002-13000:
input

US-1.815315-12000:
input

US-1.815315-9000:
input

US-1.835941-9000:
input

US-1.868229-9000:
input

US-1.891712-9000:
input

US-1.909519-9000:
input

WHAM-analysis:
README.txt
US-1.099055-9000
US-1.114885-9000
US-1.140864-9000
US-1.165709-9000
US-1.190247-9000
US-1.215514-9000
US-1.22-12000
US-1.240262-9000
US-1.264373-9000
US-1.290594-9000
US-1.316726-9000
US-1.340355-9000
US-1.36636-9000
US-1.390862-9000
US-1.411378-9000
US-1.443877-9000
US-1.465462-9000
US-1.493829-9000
US-1.51624-9000
US-1.541712-9000
US-1.56708-9000
US-1.590553-9000
US-1.61566-9000
US-1.638557-9000
US-1.661539-9000
US-1.690304-9000
US-1.715713-9000
US-1.738821-9000
US-1.76412-9000
US-1.792657-12000
US-1.792657-9000
US-1.803002-13000
US-1.815315-12000
US-1.815315-9000
US-1.835941-9000
US-1.868229-9000
US-1.891712-9000
US-1.909519-9000
makehist.plumed
metadata-220221.dat
