- Timestamp:
- 11/19/09 11:29:16 (14 years ago)
- Branches:
- master
- Children:
- 2d5d396
- Parents:
- ffd2d46
- File:
-
- 1 edited
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main.f
rffd2d46 rcb47b9c 25 25 character grpn*4,grpc*4 26 26 logical lrand,bgsposs 27 integer argc, status, argv_length 28 character(len=255) :: argv 27 29 28 30 ! =================================================== Energy setup … … 32 34 ! libraries of residues. 33 35 libdir='./SMMP/' 36 37 ! Set the maximum log level. The larger the number the more detailed 38 ! the log. 39 MAXLOGLEVEL = 1 40 ! File unit to use for the log file. 41 LOGFILEUNIT = 27 42 open(LOGFILEUNIT, file="smmp.log") 34 43 35 44 ! The switch in the following line is now not used. … … 62 71 ! =1: ab Initio from sequence (& variables) 63 72 seqfile='EXAMPLES/enkefa.seq' 64 varfile='EXAMPLES/enkefa. var'73 varfile='EXAMPLES/enkefa.ann' 65 74 ! varfile = ' ' 66 75 … … 95 104 eps = 1.0d-7 ! requested precision 96 105 call minim(imin, maxit, eps) 106 call outvar(0, ' ') 97 107 ! To do a canonical Monte Carlo simulation uncomment the lines below 98 108 ! nequi = 100
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