new file: v/VASP/VASP-5.4.4-intel-2016a-CUDA-8.0.44-mkl=sequential.eb

	deleted:    v/VASP/VASP-5.4.4-intel-2017a-CUDA-8.0.44-mkl=sequential.eb

v/VASP/VASP-5.4.4-intel-2017a-CUDA-8.0.44-mkl=sequential.eb → v/VASP/VASP-5.4.4-intel-2016a-CUDA-8.0.44-mkl=sequential.eb

@@ -2,7 +2,7 @@ easyblock = 'MakeCp'
 
 name = 'VASP'
 version = '5.4.4'
-versionsuffix = 'CUDA-8.0.44-mkl=sequential'
+versionsuffix = '-CUDA-8.0.44-mkl=sequential'
 
 homepage = 'http://www.vasp.at'
 description = """The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale
@@ -26,7 +26,6 @@ prebuildopts = 'cp arch/makefile.include.linux_intel ./makefile.include && '
 
 # path to libfftw3xf_intel.a is hardcoded in makefile.include
 prebuildopts += 'sed -i "s|\$(MKLROOT)/interfaces/fftw3xf|\$(FFTW_LIB_DIR)|" makefile.include && '
-#prebuildopts += 'sed -i "s|OBJECTS    = fftmpiw.o fftmpi_map.o fft3dlib.o fftw3d.o|OBJECTS    = fftmpiw.o fftmpi_map.o fft3dlib.o fftw3d.o \$(MKLROOT)/lib/intel64_lin/libfftw3xf_intel.a|" makefile.include && '
 
 # remove mkl flag to prevent mixing dynamic libs with the static libs in LIBBLACS/SCALAPACK
 prebuildopts += 'sed -i "s|-mkl=sequential ||" makefile.include && '
@@ -49,10 +48,10 @@ buildopts = 'std gam ncl gpu gpu_ncl'
 
 parallel = 1
 
-files_to_copy = [(['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl'], 'bin')]
+files_to_copy = [(['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl', 'bin/vasp_gpu_ncl', 'bin/vasp_gpu'], 'bin')]
 
 sanity_check_paths = {
-    'files': ['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl'],
+    'files': ['bin/vasp_std', 'bin/vasp_gam', 'bin/vasp_ncl', 'bin/vasp_gpu_ncl', 'bin/vasp_gpu'],
     'dirs': []
 }