- Timestamp:
- 11/19/09 11:29:48 (14 years ago)
- Branches:
- master
- Children:
- 7137e5d
- Parents:
- 32289cd
- File:
-
- 1 edited
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main.f
r32289cd r38d77eb 81 81 82 82 ntlml = 0 83 write ( *,*) 'Solvent: ', itysol83 write (logString, *) 'Solvent: ', itysol 84 84 ! Initialize random number generator. 85 85 call sgrnd(31433) … … 118 118 lrand = .true. 119 119 E = energy() 120 write (*,*) E, eyel,eyvw,eyhb,eyvr120 write (logString, *) E, eyel,eyvw,eyhb,eyvr 121 121 call outpdb(1, "polyA.pdb") 122 122 ! Canonical Monte Carlo 123 !call canon(nequi, nsweep, nmes, temp, lrand)123 call canon(nequi, nsweep, nmes, temp, lrand) 124 124 125 125 ! For simulated annealing uncomment the lines below
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