Difference between revisions of "DOCK Compilation"
From Rizzo_Lab
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==Compilation Blue Gene== | ==Compilation Blue Gene== | ||
For the front end node, gnu compilers work well. For the compute nodes, use the provided bluegenel and bluegenep files respectively. Note that energy grids have to be generated on the front end node in order to work on the compute nodes. Copying grids generated on a regular unix machine will not work due to different endian conventions. | For the front end node, gnu compilers work well. For the compute nodes, use the provided bluegenel and bluegenep files respectively. Note that energy grids have to be generated on the front end node in order to work on the compute nodes. Copying grids generated on a regular unix machine will not work due to different endian conventions. | ||
| + | |||
| + | Partial configuration file Makefile for BG/L | ||
| + | |||
| + | CC= blrts_xlc | ||
| + | CXX= blrts_xlC | ||
| + | BGL_SYS= /bgl/BlueLight/ppcfloor/bglsys | ||
| + | CFLAGS= -DBUILD_DOCK_WITH_MPI -DMPICH_IGNORE_CXX_SEEK \ | ||
| + | -I$(BGL_SYS)/include -lmassv \ | ||
| + | -qarch=440d -qtune=440 -qinline -O5 | ||
| + | FC= blrts_xlf90 | ||
| + | FFLAGS= -qarch-440d -qtune=440 -O5 | ||
| + | LOAD= blrts_xlC | ||
| + | LIBS= -lm -L$(BGL_SYS)/lib -lmpich.rts -lmsglayer.rts -lrts.rts -ldevices.rts | ||
| + | |||
| + | Partial configuration file for BG/P | ||
| + | |||
| + | CC= mpixlc | ||
| + | CXX= mpixlcxx | ||
| + | BGP_SYS= /bgsys/drivers/ppcfloor | ||
| + | CFLAGS= -qarch=450d -qtune=450 -O5 \ | ||
| + | -DBUILD_DOCK_WITH_MPI -DMPICH_IGNORE_CXX_SEEK | ||
| + | FC= mpixlf90 | ||
| + | FFLAGS= -qarch-450d -qtune=450 -O5 | ||
| + | LOAD= mpixlcxx | ||
| + | LIBS= -lm | ||
| + | AR= ar rv | ||
| + | LEX= flex | ||
| + | OCFLAGS= -D_ANSI_SOURCE | ||
| + | RANLIB= ranlib | ||
Latest revision as of 11:47, 18 July 2011
Generic Instructions
Untar the DOCK distribution.
cd dock6/install
Select the correct Makefile for your platform, and run the configure script.
./configure gnu make install
Compilation Blue Gene
For the front end node, gnu compilers work well. For the compute nodes, use the provided bluegenel and bluegenep files respectively. Note that energy grids have to be generated on the front end node in order to work on the compute nodes. Copying grids generated on a regular unix machine will not work due to different endian conventions.
Partial configuration file Makefile for BG/L
CC= blrts_xlc
CXX= blrts_xlC
BGL_SYS= /bgl/BlueLight/ppcfloor/bglsys
CFLAGS= -DBUILD_DOCK_WITH_MPI -DMPICH_IGNORE_CXX_SEEK \
-I$(BGL_SYS)/include -lmassv \
-qarch=440d -qtune=440 -qinline -O5
FC= blrts_xlf90
FFLAGS= -qarch-440d -qtune=440 -O5
LOAD= blrts_xlC
LIBS= -lm -L$(BGL_SYS)/lib -lmpich.rts -lmsglayer.rts -lrts.rts -ldevices.rts
Partial configuration file for BG/P
CC= mpixlc
CXX= mpixlcxx
BGP_SYS= /bgsys/drivers/ppcfloor
CFLAGS= -qarch=450d -qtune=450 -O5 \
-DBUILD_DOCK_WITH_MPI -DMPICH_IGNORE_CXX_SEEK
FC= mpixlf90
FFLAGS= -qarch-450d -qtune=450 -O5
LOAD= mpixlcxx
LIBS= -lm
AR= ar rv
LEX= flex
OCFLAGS= -D_ANSI_SOURCE
RANLIB= ranlib
