#============================================================================== # AMBER Makefile configuration for compiler/architecture: ifort # Generated via command: ./configure -opteron ifort # # Configuration script written mainly by Joe Krahn, Scott Brozell, and # Dave Case, with contributions from lots of people. #============================================================================== #------------------------------------------------------------------------------ # Main AMBER source root directory #------------------------------------------------------------------------------ AMBER_SRC=/scr/orgon/svrci/WORK/DEBUG/amber8/src #------------------------------------------------------------------------------ # AMBERBUILDFLAGS provides a hook into the build process for installers; # for example, to build debug versions of the amber programs # make -e AMBERBUILDFLAGS="-DDEBUG -g" #------------------------------------------------------------------------------ AMBERBUILDFLAGS= #------------------------------------------------------------------------------ # LOCALFLAGS is intended for program specific modifications to the # Fortran build process and may be modified by the program's local makefile #------------------------------------------------------------------------------ LOCALFLAGS= #------------------------------------------------------------------------------ # Availability and method of delivery of math and optional libraries #------------------------------------------------------------------------------ USE_BLASLIB=$(VENDOR_SUPPLIED) USE_LAPACKLIB=$(VENDOR_SUPPLIED) USE_LMODLIB=$(LMOD_UNAVAILABLE) #------------------------------------------------------------------------------ # C compiler #------------------------------------------------------------------------------ CC= gcc CPLUSPLUS=g++ ALTCC=gcc CFLAGS=-O2 $(AMBERBUILDFLAGS) ALTCFLAGS= $(AMBERBUILDFLAGS) CPPFLAGS= $(AMBERBUILDFLAGS) #------------------------------------------------------------------------------ # Fortran preprocessing and compiler. # FPPFLAGS holds the main Fortran options, such as whether MPI is used. #------------------------------------------------------------------------------ FPPFLAGS= -P -I$(AMBER_SRC)/include -DMKL $(AMBERBUILDFLAGS) FPP= cpp -traditional $(FPPFLAGS) FC= ifort FFLAGS= -w95 -mp1 -O0 $(LOCALFLAGS) $(AMBERBUILDFLAGS) FOPTFLAGS= -w95 -mp1 -ip -O3 -xW $(LOCALFLAGS) $(AMBERBUILDFLAGS) FPP_PREFIX= _ FREEFORMAT_FLAG= -FR #------------------------------------------------------------------------------ # Loader: #------------------------------------------------------------------------------ LOAD= ifort $(LOCALFLAGS) $(AMBERBUILDFLAGS) LOADCC= gcc $(LOCALFLAGS) $(AMBERBUILDFLAGS) LOADLIB= -L/opt/intel/mkl721/lib/em64t -lvml -lmkl_lapack64 -lmkl -lguide -lpthread -nofor_main LOADPTRAJ= ifort $(LOCALFLAGS) $(AMBERBUILDFLAGS) XHOME= /usr/X11R6 #------------------------------------------------------------------------------ # Other stuff: #------------------------------------------------------------------------------ .SUFFIXES: .f90 SYSDIR=lib AR=ar rv M4=m4 RANLIB=ranlib SFX= MAKEDEPEND=$(AMBER_SRC)/../bin/amber_makedepend # default rules for Fortran and C compilation: .f.o: $< $(FPP) $< > $(FPP_PREFIX)$< $(FC) -c $(FFLAGS) -o $@ $(FPP_PREFIX)$< .f90.o: $< $(FPP) $< > $(FPP_PREFIX)$< $(FC) -c $(FFLAGS) -o $@ $(FPP_PREFIX)$< .c.o: $(CC) -c $(CFLAGS) $(CPPFLAGS) -o $@ $<