X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MIN%2Fenergy_p_new_barrier.F;h=96df440827b820dd063ada75fb0f3ba4d3b112ca;hb=b2f7e526886daf6e40d636d508f914044f965a8d;hp=9059c022850dc9faad094401d1f9d0499ad83494;hpb=599d009baac6b0c6e8fad32a26767695425130e5;p=unres.git diff --git a/source/unres/src_MIN/energy_p_new_barrier.F b/source/unres/src_MIN/energy_p_new_barrier.F index 9059c02..96df440 100644 --- a/source/unres/src_MIN/energy_p_new_barrier.F +++ b/source/unres/src_MIN/energy_p_new_barrier.F @@ -1448,7 +1448,7 @@ C logical lprn evdw=0.0D0 ccccc energy_dec=.false. -c print *,'Entering EGB nnt=',nnt,' nct=',nct,' expon=',expon +c write(iout,*) 'Entering EGB nnt=',nnt,' nct=',nct,' expon=',expon evdw=0.0D0 evdw_p=0.0D0 evdw_m=0.0D0 @@ -8007,7 +8007,7 @@ c---------------------------------------------------------------------------- include 'COMMON.GEO' logical swap double precision vv(2),pizda(2,2),auxmat(2,2),auxvec(2), - & auxvec1(2),auxvec2(1),auxmat1(2,2) + & auxvec1(2),auxvec2(2),auxmat1(2,2) logical lprn common /kutas/ lprn CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC