X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2Fnew%2Fmicrocanonical%2FRESPA%2Fff_gab%2Funres.csh;h=2632a379ae7d72aa62e626ccd8786528c52a7158;hb=d5f5162b182a8b2f7a40d50b6877beb2a52297bc;hp=68f562a6997cd58c9a4f1e4700066260c29f5d33;hpb=0159dffb0c6ab8021f45dc01794d77b091499a4d;p=unres.git diff --git a/examples/unres/new/microcanonical/RESPA/ff_gab/unres.csh b/examples/unres/new/microcanonical/RESPA/ff_gab/unres.csh index 68f562a..2632a37 100755 --- a/examples/unres/new/microcanonical/RESPA/ff_gab/unres.csh +++ b/examples/unres/new/microcanonical/RESPA/ff_gab/unres.csh @@ -4,7 +4,8 @@ setenv POT GB setenv PREFIX 1L2Y_micro setenv OUT1FILE YES #----------------------------------------------------------------------------- -setenv UNRES_BIN /users/adam/unres/bin/unres/MD/unres_ifort_MPICH_GAB.exe +#setenv UNRES_BIN /users/adam/unres/bin/unres/MD/unres_ifort_MPICH_GAB.exe +setenv UNRES_BIN /users/pk376/DLAPAWLA/unres_ifort_MPICH_GAB.exe #----------------------------------------------------------------------------- setenv DD /users/aks255/newUNRES/unres/PARAM setenv BONDPAR $DD/bond.parm