c -- I/O units integer :: inp = 1 integer :: ow = 3 integer :: opopsum = 4 integer :: pdb = 5 integer :: olog = 6 integer :: iwham = 7 integer :: owham = 8 integer :: imremd = 9 integer :: omremd = 10 integer :: izscore = 11 integer :: ozscore = 12 integer :: iscript = 13 integer :: oscript = 14 integer :: ostate = 15 integer :: izsoptw = 16 ! zscore optimized weights files integer :: izenergy = 17 integer :: iobank = 18 integer :: obankh = 19 ! csa bank history file c -- I/O filenames character*20 :: owfn = "weights" character*20 :: inpfn = "unresga.inp" ! Main input file character*20 :: ologfn = "unresga.log" ! Log c character*20 :: iwhamfn = "wham.tpl" ! wham input template file character*20 :: owhamfn = "wham.inp" ! wham input file c character*20 :: imremdfn = "mremd.tpl" ! mremd input template file character*20 :: omremdfn = "mremd.inp" ! mremd input file character*20 :: izscorefn = "zscore.tpl" ! zscore input template file character*20 :: ozscorefn = "zscore.inp" ! zscore input file character*20 :: opopsumfn = "population.summary" character*20 :: ostatefn = "unresga.state" ! unresga state file character*20 :: izenergyfn = "zscore.out_par" ! zscore generated output prefix character*20 :: iobankfn = "unresga.bank" ! csa current bank file character*20 :: obankhfn = "unresga.bank.history" ! csa bank history file