New valence-torsionals completed

[unres.git] / source / unres / src_MD-M / Makefile_MPICH_ifort

diff --git a/source/unres/src_MD-M/Makefile_MPICH_ifort b/source/unres/src_MD-M/Makefile_MPICH_ifort
index 0d2a6d4..7ce0741 100644 (file)
--- a/source/unres/src_MD-M/Makefile_MPICH_ifort
+++ b/source/unres/src_MD-M/Makefile_MPICH_ifort
@@ -5,11 +5,13 @@ INSTALL_DIR = /users/software/mpich-1.2.7p1_intel-10.1_em64_ssh
 FC= ifort
 
 OPT =  -O3 -ip 
+OPT =  -g -CA -CB
 
 FFLAGS = -c ${OPT} -I$(INSTALL_DIR)/include 
 FFLAGS1 = -c  -g -CA -CB -I$(INSTALL_DIR)/include 
 FFLAGS2 = -c  -g -O0 -I$(INSTALL_DIR)/include  
 FFLAGSE = -c  -O3 -ipo  -opt_report -I$(INSTALL_DIR)/include
+FFLAGSE = ${FFLAGS}
 
 
 LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a
@@ -47,7 +49,7 @@ no_option:
 
 GAB: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
        -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
-GAB: BIN = ../../../bin/unres/MD/unres-mult-symetr_ifort_MPICH_GAB.exe
+GAB: BIN = /users/adam/bin/unres/MD/unres-mult-symetr_KCC_ifort_MPICH_GAB.exe
 GAB: ${object} xdrf/libxdrf.a
        cc -o compinfo compinfo.c
        ./compinfo | true
@@ -56,7 +58,7 @@ GAB: ${object} xdrf/libxdrf.a
 
 4P: CPPFLAGS = -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
        -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
-4P: BIN = ../../../bin/unres/MD/unres-mult-symetr_ifort_MPICH_4P.exe
+4P: BIN = /users/adam/bin/unres-mult-symetr_KCC_ifort_MPICH_4P.exe
 4P: ${object} xdrf/libxdrf.a
        cc -o compinfo compinfo.c
        ./compinfo | true
@@ -65,13 +67,22 @@ GAB: ${object} xdrf/libxdrf.a
 
 E0LL2Y: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
        -DSPLITELE -DLANG0
-E0LL2Y: BIN = ../../../bin/unres/MD/unres-mult-symetr_ifort_MPICH_E0LL2Y.exe
+E0LL2Y: BIN = /users/adam/bin/unres-mult-symetr_KCC_ifort_MPICH_E0LL2Y.exe
 E0LL2Y: ${object} xdrf/libxdrf.a
        cc -o compinfo compinfo.c
        ./compinfo | true
        ${FC} ${FFLAGS} cinfo.f
        ${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}
 
+NEWCORR: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
+       -DSPLITELE -DLANG0 -DNEWCORR
+NEWCORR: BIN = /users/adam/bin/unres-mult-symetr_KCC_ifort_MPICH_E0LL2Y-NEWCORR.exe
+NEWCORR: ${object} xdrf/libxdrf.a
+       cc -o compinfo compinfo.c
+       ./compinfo | true
+       ${FC} ${FFLAGS} cinfo.f
+       ${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}
+
 xdrf/libxdrf.a:
        cd xdrf && make