1 integer*4 :: timeArray(4) ! used for random seed
2 integer*4 :: npdb = 0 ! number of pdb files
3 integer*4 :: ntwham = 0 ! number of WHAM template files
4 integer*4 :: ntmremd = 0 ! number of MREMD template files
5 integer*4 :: nscripts = 0 ! number of shell scripts to copy
6 integer*4 :: maxgen = 0 ! maximum number of generations
7 integer*4 :: banksize = 0 ! size of bank
8 integer*4 :: generation = 1 ! current generation
9 integer*4 :: maxminstep = 0 ! max minimalization to be done by zscore
10 integer*4,parameter :: maxnpdb = 10 ! hard limit for maximum number of proteins
11 integer*4,parameter :: maxscripts = 10
12 real*8 :: cicutoff = 5.0 ! CSA initial cutoff
13 real*8 :: csacutoff = 0.0 ! CSA cutoff
14 logical :: do_optima = .false.
15 logical :: do_ga = .false.
16 logical :: do_fs = .false.
17 character*32 :: pdbfiles(maxnpdb)
18 character*32 :: scripts(maxscripts)
19 character*32 :: whamtemplate(maxnpdb)
20 character*32 :: mremdtemplate(maxnpdb)
23 common /inputy/ npdb,nscripts,ntwham,ntmremd,maxgen,banksize,cicut&
24 &off,csacutoff,alg,pdbfiles,scripts,whamtemplate,mremdtemplate,gene&
25 &ration,maxminstep,do_optima, do_ga
26 character*7 :: version = "1.1.1"
27 character*50 :: info = "= Last modified by Lightnir 09/01/2012"
28 real*8,allocatable :: bank(:,:),populacja(:,:),temppopulacja(:,:)
29 integer*4, allocatable :: pairs(:)