X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2Fcxread.F;h=15777b1bd91fde55ee58c45af7edd5d6bfadff64;hb=971fdfc78bace0d56dd440cf9501ab2eb25a1dcf;hp=c0319f6f68077484eaeecd2b30c780a0c5ee34c2;hpb=c67de1dba6e593dfb17438f5dd213ec1494a144a;p=unres.git diff --git a/source/wham/src-M/cxread.F b/source/wham/src-M/cxread.F index c0319f6..15777b1 100644 --- a/source/wham/src-M/cxread.F +++ b/source/wham/src-M/cxread.F @@ -168,6 +168,20 @@ c call flush(iout) enddo enddo +c Box shift + call oligomer + do i=1,nres + do j=1,3 + xoord(j,i)=c(j,i) + enddo + enddo + do i=1,nct-nnt+1 + do j=1,3 + xoord(j,i+nres)=c(j,i+nres+nnt-1) + enddo + enddo +c end change + if (islice.gt.0 .and. islice.le.nslice .and. (.not.separate_parset & .or. iset.eq.myparm)) then ii=ii+1