X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MIN%2Freadpdb.F;h=1d79870bd7d687d521282b613689c066d09b0306;hb=655daea8c92192b68d2be86cf580c3fb68143e19;hp=dacd12d2f2b29a8aa6975739283bb4f7e2755e09;hpb=ffdab8e1a4782a031ac72eef5416fd12a1dd3722;p=unres.git diff --git a/source/unres/src_MIN/readpdb.F b/source/unres/src_MIN/readpdb.F index dacd12d..1d79870 100644 --- a/source/unres/src_MIN/readpdb.F +++ b/source/unres/src_MIN/readpdb.F @@ -258,6 +258,9 @@ c endif enddo iti=itype(i) di=dist(i,nres+i) +C 9/29/12 Adam: Correction for zero SC-SC bond length + if (itype(i).ne.10 .and. itype(i).ne.21. and. di.eq.0.0d0) + & di=dsc(itype(i)) vbld(i+nres)=di if (itype(i).ne.10) then vbld_inv(i+nres)=1.0d0/di