MD-Bench/include_GROMACS.mk
Rafael Ravedutti af92800c64 Add SIMD version with AVX (no AVX2) and XTC output
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-03-02 23:12:04 +01:00

12 lines
280 B
Makefile

GROMACS_PATH=/apps/Gromacs/2018.1-mkl
GROMACS_INC ?= -I${GROMACS_PATH}/include
GROMACS_DEFINES ?=
GROMACS_LIB ?= -L${GROMACS_PATH}/lib64
ifeq ($(strip $(XTC_OUTPUT)),true)
INCLUDES += ${GROMACS_INC}
DEFINES += ${GROMACS_DEFINES}
LIBS += -lgromacs
LFLAGS += ${GROMACS_LIB}
endif