Commit afbde393 authored by Adam Hospital's avatar Adam Hospital
Browse files

fixed fileref bug

parent 60421b5f
Pipeline #5857 skipped
......@@ -52,6 +52,7 @@ real*8 :: hstep=1.0
REAL :: errorAcceptable=1.00 ! 1.25 should be the value
INTEGER :: nskip=5
REAL :: sigmaFake=0.02
CHARACTER(LEN=20) :: fileref='reference.pdb'
real:: RMSD_DIF=0.01 ! A
real*8::rcontacts=50.0d0
LOGICAL :: writingStandard = .TRUE.
......@@ -60,10 +61,10 @@ CONTAINS
!===============================================================================
subroutine readInputParamSet (unit_i)
integer, intent(IN) :: unit_i
character(100) fileref
!
namelist /input/ tsnap,temp,seed,nbloc,scalFactor,Ener_evo_size,&
Ener_evo_size,nskip,tact,errorAcceptable,writingStandard,fileref,natomMin
! Ener_evo_size,nskip,tact,errorAcceptable,writingStandard,fileref,natomMin
Ener_evo_size,nskip,tact,errorAcceptable,writingStandard,natomMin
!
read (unit_i, INPUT)
! checking
......
......@@ -120,4 +120,3 @@
logical:: finishMD
real(dbl):: errorBKP=10000.0
character(100) fileref
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