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adding ebend_nucl to UCGM+some further reading
[unres4.git]
/
source
/
unres
/
MCM_MD.f90
diff --git
a/source/unres/MCM_MD.f90
b/source/unres/MCM_MD.f90
index
2296ddb
..
657f082
100644
(file)
--- a/
source/unres/MCM_MD.f90
+++ b/
source/unres/MCM_MD.f90
@@
-1920,7
+1920,7
@@
i2=winend(i)
it1=itype(i1,1)
it2=itype(i2,1)
i2=winend(i)
it1=itype(i1,1)
it2=itype(i2,1)
- write (iout,'(a,i3,a,i3,a,i3)') restyp(it1),i1,restyp(it2),i2,&
+ write (iout,'(a,i3,a,i3,a,i3)') restyp(it1,1),i1,restyp(it2,1),i2,&
' length',winlen(i)
enddo
endif
' length',winlen(i)
enddo
endif
@@
-3074,7
+3074,7
@@
goto 301
endif
if (print_mc.gt.1) write (iout,'(2a,i4,a,2f8.3)') &
goto 301
endif
if (print_mc.gt.1) write (iout,'(2a,i4,a,2f8.3)') &
- 'Side chain ',restyp(iti),ii,' moved to ',&
+ 'Side chain ',restyp(iti,1),ii,' moved to ',&
alph(ii)*rad2deg,omeg(ii)*rad2deg
enddo
moves(3)=moves(3)+1
alph(ii)*rad2deg,omeg(ii)*rad2deg
enddo
moves(3)=moves(3)+1