X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=source%2Funres%2Fsrc_MD%2Fcheckder_p.F;fp=source%2Funres%2Fsrc_MD%2Fcheckder_p.F;h=fc11c2e5d599a19812cb0d0c5a6f1fe0be4e0b2a;hp=08b7a3233ebd6adb8096eeace50229b4b33dc726;hb=53a17fa4587252a39b479d21a6062bfdbe5ccb81;hpb=6f0e7ef07e02a56fff97df63bd7f07d4b6fb50ce diff --git a/source/unres/src_MD/checkder_p.F b/source/unres/src_MD/checkder_p.F index 08b7a32..fc11c2e 100644 --- a/source/unres/src_MD/checkder_p.F +++ b/source/unres/src_MD/checkder_p.F @@ -284,7 +284,7 @@ C Check the gradient of the energy in Cartesian coordinates. c call intcartderiv c call checkintcartgrad call zerograd - aincr=1.0D-6 + aincr=1.0D-4 write(iout,*) 'Calling CHECK_ECARTINT.' nf=0 icall=0