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GU: Compiling GAMESS in Linux/ELF
First an admission, I don't have too much of an idea as to what I'm doing.
I'm attempting to compile GAMESS on a 486DX4-120/32MB RAM/Redhat Linux
3.0.3/Kernel 2.0.0/bash shell/gcc-2.7.2/f2c.
First, what I do know. The f2c/gcc combination works, I have successfully
compiled MOPAC7. I have read the documentation with the GAMESS source code
(quite candidly (count your fingers) I can't say that I understood all of
it). I have edited compall and comp for TARGET=pcunix and the path to the
source code. I have successfully (as far as I can tell, at least there were
no warning or error messages) setup the source code activator and can run
the first part of compall.
Everything is fine until compall gets to the section that activates and
compiles the individual source files and then I get a series of
comp:command not found error messages and eventually the script aborts. I
have loaded the csh shell and started it once my Linux OS is finished
booting. I get exactly the same results.
Now, I really need to be able to use GAMESS for my computational chemistry
research, but, as I have admitted, I am neither a hardware nor a OS type of
person. I need all of the help that people are willing to give.
I'll be haoppy to furnish any more information that may be needed to solve
these problems, assumint that I can understand the questions.
TIA
date
Wed Aug 21 15:16:21 EDT 1996
set TARGET=pcunix
cd /usr/local/src/gamess
cc -c source/zunix.c
mv -i zunix.o object/zunix.o
mv: replace `object/zunix.o'? if ( pcunix == decmips ) cc -DULTRIX4 -c source/zmips.c
if ( pcunix == mips ) cc -DMIPS source/zmips.c -o zmips -systype bsd43
if ( pcunix == sgi ) cc -DSGI -c source/zmips.c
if ( -e zmips.o ) mv zmips.o object/zmips.o
if ( pcunix == intel ) then
if ( ( pcunix == hp9000 ) | ( pcunix == convexspp ) ) then
if ( pcunix == pcunix ) then
cc -c source/zpcunix.c
mv -i zpcunix.o object
mv: replace `object/zpcunix.o'? endif
if ( pcunix == necsx ) then
if ( pcunix == cray-t3d ) then
if ( pcunix == apollo ) comp blas
if ( pcunix == decmips ) comp blas
if ( pcunix == decaxpf77 ) comp blas
if ( pcunix == decaxpf90 ) comp blas
if ( pcunix == fujitsu ) comp blas
if ( pcunix == mips ) comp blas
if ( pcunix == pcunix ) comp blas
comp blas
comp: Command not found.
if ( pcunix == sgi ) comp blas
if ( pcunix == sgi8000 ) comp blas
if ( pcunix == sun ) comp blas
if ( pcunix == tmc ) comp blas
if ( pcunix == alliant ) comp vector
if ( pcunix == ardent ) comp vector
if ( pcunix == convex ) comp vector
if ( pcunix == cray ) comp vector
if ( pcunix == fps500 ) comp vector
if ( pcunix == fujitsu ) comp vector
if ( pcunix == ibm370 ) comp vector
if ( pcunix == necsx ) comp vector
comp basecp
comp: Command not found.
comp basext
comp: Command not found.
comp bashuz
comp: Command not found.
comp bashz2
comp: Command not found.
comp basn21
comp: Command not found.
comp basn31
comp: Command not found.
comp bassto
comp: Command not found.
comp cphf
comp: Command not found.
comp cprohf
comp: Command not found.
comp drc
comp: Command not found.
comp ecp
comp: Command not found.
comp ecphw
comp: Command not found.
comp ecplib
comp: Command not found.
comp ecpsbk
comp: Command not found.
comp eigen
comp: Command not found.
if ( -e ef/efinp.src ) then
comp efdmy
comp: Command not found.
endif
comp ffield
comp: Command not found.
comp frfmt
comp: Command not found.
comp gamess
comp: Command not found.
comp gradex
comp: Command not found.
comp grd1
comp: Command not found.
comp grd2a
comp: Command not found.
comp grd2b
comp: Command not found.
comp grd2c
comp: Command not found.
comp guess
comp: Command not found.
comp gugdga
comp: Command not found.
comp gugdgb
comp: Command not found.
comp gugdm
comp: Command not found.
comp gugdm2
comp: Command not found.
comp gugdrt
comp: Command not found.
comp gugem
comp: Command not found.
comp gugsrt
comp: Command not found.
comp gvb
comp: Command not found.
comp hess
comp: Command not found.
comp hss1a
comp: Command not found.
comp hss1b
comp: Command not found.
comp hss2a
comp: Command not found.
comp hss2b
comp: Command not found.
comp inputa
comp: Command not found.
comp inputb
comp: Command not found.
comp inputc
comp: Command not found.
comp int1
comp: Command not found.
comp int2a
comp: Command not found.
comp int2b
comp: Command not found.
comp iolib
comp: Command not found.
comp lagran
comp: Command not found.
comp local
comp: Command not found.
comp loccd
comp: Command not found.
comp locpol
comp: Command not found.
comp mcscf
comp: Command not found.
comp mctwo
comp: Command not found.
comp morokm
comp: Command not found.
comp mp2
comp: Command not found.
comp mp2grd
comp: Command not found.
comp mpcdat
comp: Command not found.
comp mpcgrd
comp: Command not found.
comp mpcint
comp: Command not found.
comp mpcmol
comp: Command not found.
comp mpcmsc
comp: Command not found.
comp mthlib
comp: Command not found.
comp nameio
comp: Command not found.
comp ordint
comp: Command not found.
comp parley
comp: Command not found.
comp prpel
comp: Command not found.
comp prplib
comp: Command not found.
comp prppop
comp: Command not found.
comp rhfuhf
comp: Command not found.
comp rxncrd
comp: Command not found.
comp ryspol
comp: Command not found.
comp scflib
comp: Command not found.
comp scrf
comp: Command not found.
comp spnorb
comp: Command not found.
comp statpt
comp: Command not found.
comp stub
comp: Command not found.
comp surf
comp: Command not found.
comp symorb
comp: Command not found.
comp symslc
comp: Command not found.
comp tcgstb
comp: Command not found.
comp tdhf
comp: Command not found.
comp trans
comp: Command not found.
comp trnstn
comp: Command not found.
comp trudge
comp: Command not found.
comp unport
comp: Command not found.
comp vibanl
comp: Command not found.
comp zheev
comp: Command not found.
comp zmatrx
comp: Command not found.
unset echo
------------------- done with all compilations --------------------
Wed Aug 21 15:16:27 EDT 1996
0.8u 0.9s 0:06.70 27.4% 0+0k 0+0io 2007pf+0w
______________________________________________________________________________
Stephen P. Molnar, Ph. D. Life is a fuzzy set
Foundation for Chemistry multivariant and stochastic
614.486.4076