X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fcheckgrad.awk;h=c638b3db6946c26e0daccebbe5ab6c27c77a8368;hb=ba8f40a2336651a42eb42e9d3379d62aa11bb5d7;hp=1280b1c50f5c8c809c24e2d8da69147ed9af102c;hpb=3c4b74abd9458e0fa5d76fa865c423b69eefba3f;p=unres.git

diff --git a/ctest/checkgrad.awk b/ctest/checkgrad.awk
index 1280b1c..c638b3d 100644
--- a/ctest/checkgrad.awk
+++ b/ctest/checkgrad.awk
@@ -22,7 +22,7 @@ if (found==2 && NF>0) {
   a[i,k+j]=strtonum(substr($0,4+j*12,12))
 #  print "OOO",i,j,k,k+j,a[i,k+j]
 #  print "AAA",i,a[2,k+j]
-  if(i==3 && a[2,k+j]!=0) {
+  if(i==3 && ( a[2,k+j]>0.0000001 || a[2,k+j]<-0.0000001) ) {
    kk++
    d[kk]=a[i,k+j]
 #   print "III",i,j,k,kk,d[kk]