Hi Sam. Please modify the file. Remove the old two alias to relax, and make a new alias to the newest version of relax.
You could/should also include the module load command here. Then open a new terminal. Try again with mpirun, etc. Den mandag den 3. oktober 2016 skrev Mahdi, Sam <sam.mahdi....@my.csun.edu>: > Hi Troels, > > So it was the tcshrc here was the output > lias rm 'rm -i' > alias cp 'cp -i' > alias mv 'mv -i' > > setenv NMR_CONT CORRECT_ALL > setenv GLOVEDIR ~/glove > > if (-e /usr/local/NMRPipe/com/nmrInit.linux9.com) then > source /usr/local/NMRPipe/com/nmrInit.linux9.com > endif > > set PATH = ($PATH /usr/local/java:$GLOVEDIR/bin) > > alias relax '/usr/local/relax-1.3.10/relax -g' > > alias csi '/usr/local//csi' > > alias nvj '/usr/local/bin/NMRViewJ' > > alias pymol '/usr/local/pymol/pymol.exe' > > alias nessy '/usr/local/nessy/nessy' > > alias relax '/usr/local/Relax/relax-2.2.5/relax -g' > #set prompt="crowlab >" > > alias naccess '/usr/local/Naccess/naccess2.1.1/naccess' > > if( ${?prompt} ) then > alias setprompt 'set prompt = "crowlab: [%c]> "' > alias cwdcmd 'setprompt' > setprompt > endif > > Also, the 2nd command gave me no responce. > crowlab: [~]> alias get 'set noglob; wget http://svn.gna.org/viewcvs/* > checkout*/relax/trunk/devel_scripts/openmpi_test_install_tcsh.sh;unset > noglob' > crowlab: [~]> > > > On Mon, Oct 3, 2016 at 9:32 AM, Troels Emtekær Linnet < > tlin...@nmr-relax.com > <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> wrote: > >> Hi Sam. >> >> I know your problem. :) >> It is the same for me. Getting hang of a system admin for our lab >> computers, and then to convince him/her >> to fix stuff is not easy. >> >> Thats why I test on Google Cloud. >> There I can get access to a multi core computer, and mess with it. >> >> But it only has a set of standard images. And Fedora is not one of them. >> >> But we can try to have a look at your personal shell setup. >> Can you display your login script?: >> >> One of these should be the right one. >> --- >> cat $HOME/.cshrc >> cat $HOME/.login, >> cat $HOME/.tcshrc >> --- >> >> And now try as well: >> --- >> alias get 'set noglob; wget http://svn.gna.org/viewcvs/*ch >> eckout*/relax/trunk/devel_scripts/openmpi_test_install_tcsh.sh;unset >> noglob' >> get >> >> # Source functions >> source openmpi_test_install_tcsh.sh >> testopenmpi >> ----- >> >> 2016-10-03 18:13 GMT+02:00 Mahdi, Sam <sam.mahdi....@my.csun.edu >> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >> >>> Hi Troels, >>> >>> It will be a bit difficult for me to attempt to update, remove, or >>> install any packages since I am not root user, which means I'd have to wait >>> for my PI to come and install/remove packages or programs. Anything >>> regarding installing programs on a user basis I can do (such as installing >>> relax), but I can not for example, install mpi4py. I can download it, untar >>> it, even compile it using the mpicc wrapper, but I cannot install it. I >>> know we discussed the potential problem could be because I have 2 version >>> of relax on my system. Could you try to potentially download another >>> version of relax (the other one I have is 2.2.5) and the older version of >>> openmpi, and attempt to run it then? It would be a lot easier for me to >>> directly tell my PI to simply remove a file, or update one, then to attempt >>> to troubleshoot with them. >>> >>> Sincerely, >>> Sam >>> >>> On Mon, Oct 3, 2016 at 8:58 AM, Troels Emtekær Linnet < >>> tlin...@nmr-relax.com >>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> wrote: >>> >>>> Hi Sam. >>>> >>>> I can get relax to run and work on redhat/centos version 6. >>>> >>>> I have updated a deployment script for this: >>>> http://wiki.nmr-relax.com/Run_relax_at_Google_Cloud_Computin >>>> g#Install_packages_at_server >>>> >>>> Please have a look here: >>>> http://svn.gna.org/viewcvs/relax/trunk/devel_scripts/deploy_scripts/ >>>> >>>> and specific: >>>> http://svn.gna.org/viewcvs/*checkout*/relax/trunk/devel_scri >>>> pts/deploy_scripts/deploy_google_computing_redhat_6_86_x64_u >>>> pgrade_python.sh?content-type=text%2Fplain >>>> >>>> This is for centos 6, which should get very close to fedora 20. >>>> >>>> For centos 6, the openmpi is version 1.8. And you have 1.7.3 >>>> >>>> So, the only difference I can see is the openmpi version. >>>> Can you upgrade this? >>>> >>>> ------ >>>> [tlinnet@instance-1 ~]$ relax_4.0.2 -i >>>> >>>> >>>> >>>> relax 4.0.2 >>>> >>>> Molecular dynamics by NMR data analysis >>>> >>>> Copyright (C) 2001-2006 Edward d'Auvergne >>>> Copyright (C) 2006-2016 the relax development >>>> team >>>> >>>> This is free software which you are welcome to modify and redistribute >>>> under the conditions of the >>>> GNU General Public License (GPL). This program, including all modules, >>>> is licensed under the GPL >>>> and comes with absolutely no warranty. For details type 'GPL' within >>>> the relax prompt. >>>> >>>> Assistance in using the relax prompt and scripting interface can be >>>> accessed by typing 'help' within >>>> the prompt. >>>> >>>> Processor fabric: Uni-processor. >>>> >>>> >>>> Hardware information: >>>> Machine: x86_64 >>>> Processor: x86_64 >>>> Processor name: Intel(R) Xeon(R) CPU @ 2.50GHz >>>> Endianness: little >>>> Total RAM size: 3426 Mb >>>> Total swap size: 0 Mb >>>> >>>> Operating system information: >>>> System: Linux >>>> Release: 2.6.32-642.4.2.el6.x86_64 >>>> Version: #1 SMP Tue Aug 23 19:58:13 UTC 2016 >>>> GNU/Linux version: CentOS 6.8 Final >>>> Distribution: centos 6.8 Final >>>> Full platform string: Linux-2.6.32-642.4.2.el6.x86_ >>>> 64-x86_64-with-centos-6.8-Final >>>> >>>> Python information: >>>> Architecture: 64bit ELF >>>> Python version: 2.7.8 >>>> Python branch: >>>> Python build: default, May 15 2016 12:46:09 >>>> Python compiler: GCC 4.4.7 20120313 (Red Hat 4.4.7-16) >>>> Libc version: glibc 2.2.5 >>>> Python implementation: CPython >>>> Python revision: >>>> Python executable: /opt/rh/python27/root/usr/bin/python >>>> Python flags: sys.flags(debug=0, py3k_warning=0, >>>> division_warning=0, division_new=0, inspect=0, interactive=0, optimize=0, >>>> dont_write_bytecode=0, no_user_site=0, no_site=0, ignore_environment=0, >>>> tabcheck=0, verbose=0, unicode=0, bytes_warning=0, hash_randomization=0) >>>> Python float info: sys.float_info(max=1.7976931348623157e+308, >>>> max_exp=1024, max_10_exp=308, min=2.2250738585072014e-308, min_exp=-1021, >>>> min_10_exp=-307, dig=15, mant_dig=53, epsilon=2.220446049250313e-16, >>>> radix=2, rounds=1) >>>> Python module path: ['/home/tlinnet/relax-4.0.2', >>>> '/usr/lib64/python2.6/site-packages/openmpi', >>>> '/usr/lib64/python2.6/site-packages/wx-2.8-gtk2-unicode', >>>> '/opt/rh/python27/root/usr/lib64/python27.zip', >>>> '/opt/rh/python27/root/usr/lib64/python2.7', >>>> '/opt/rh/python27/root/usr/lib64/python2.7/plat-linux2', >>>> '/opt/rh/python27/root/usr/lib64/python2.7/lib-tk', >>>> '/opt/rh/python27/root/usr/lib64/python2.7/lib-old', >>>> '/opt/rh/python27/root/usr/lib64/python2.7/lib-dynload', >>>> '/opt/rh/python27/root/usr/lib64/python2.7/site-packages', >>>> '/opt/rh/python27/root/usr/lib/python2.7/site-packages'] >>>> >>>> Python packages and modules (most are optional): >>>> >>>> Name Installed Version Path >>>> >>>> minfx True 1.0.12 >>>> /home/tlinnet/relax-4.0.2/minfx >>>> bmrblib True 1.0.4 >>>> /home/tlinnet/relax-4.0.2/bmrblib >>>> numpy True 1.7.1 >>>> /opt/rh/python27/root/usr/lib64/python2.7/site-packages/numpy >>>> scipy True 0.12.1 >>>> /opt/rh/python27/root/usr/lib64/python2.7/site-packages/scipy >>>> wxPython True 2.8.12.0 (gtk2-unicode) >>>> /usr/lib64/python2.6/site-packages/wx-2.8-gtk2-unicode/wx >>>> matplotlib True 1.5.3 >>>> /opt/rh/python27/root/usr/lib64/python2.7/site-packages/matplotlib >>>> mpi4py True 2.0.0 >>>> /opt/rh/python27/root/usr/lib64/python2.7/site-packages/mpi4py >>>> epydoc True 3.0.1 >>>> /opt/rh/python27/root/usr/lib/python2.7/site-packages/epydoc >>>> optparse True 1.5.3 >>>> /opt/rh/python27/root/usr/lib64/python2.7/optparse.pyc >>>> readline True >>>> /opt/rh/python27/root/usr/lib64/python2.7/lib-dynload/readline.so >>>> profile True >>>> /opt/rh/python27/root/usr/lib64/python2.7/profile.pyc >>>> bz2 True >>>> /opt/rh/python27/root/usr/lib64/python2.7/lib-dynload/bz2.so >>>> gzip True >>>> /opt/rh/python27/root/usr/lib64/python2.7/gzip.pyc >>>> io True >>>> /opt/rh/python27/root/usr/lib64/python2.7/io.pyc >>>> xml True 0.8.4 (internal) >>>> /opt/rh/python27/root/usr/lib64/python2.7/xml/__init__.pyc >>>> xml.dom.minidom True >>>> /opt/rh/python27/root/usr/lib64/python2.7/xml/dom/minidom.pyc >>>> >>>> relax information: >>>> Version: 4.0.2 >>>> Processor fabric: Uni-processor. >>>> >>>> relax C modules: >>>> >>>> Module Compiled File type >>>> Path >>>> >>>> target_functions.relax_fit True ELF 64-bit LSB shared object, >>>> x86-64, version 1 (SYSV), dynamically linked, not stripped >>>> /home/tlinnet/relax-4.0.2/target_functions/relax_fit.so >>>> --------- >>>> >>>> [tlinnet@instance-1 ~]$ source openmpi_test_install_bash.sh >>>> http://svn.gna.org/viewcvs/*checkout*/relax/trunk/devel_scri >>>> pts/openmpi_test_install_bash.sh >>>> Source the commands with: source openmpi_test_install_bash.sh >>>> Then do: testopenmpi >>>> >>>> [tlinnet@instance-1 ~]$ testopenmpi >>>> This is functions to test openmpi, python and openmpi. >>>> >>>> Shell is: /bin/bash >>>> >>>> > which mpirun >>>> /usr/lib64/openmpi/bin/mpirun >>>> >>>> > module avail >>>> >>>> -------------------------------------------------------------------------------------- >>>> /usr/share/Modules/modulefiles ------------------------------ >>>> -------------------------------------------------------- >>>> dot module-git module-info modules null use.own >>>> >>>> ------------------------------------------------------------ >>>> --------------------------------- /etc/modulefiles >>>> ------------------------------------------------------------ >>>> --------------------------------- >>>> openmpi-1.8-x86_64 openmpi-x86_64 >>>> >>>> > lscpu >>>> Architecture: x86_64 >>>> CPU op-mode(s): 32-bit, 64-bit >>>> Byte Order: Little Endian >>>> CPU(s): 4 >>>> On-line CPU(s) list: 0-3 >>>> Thread(s) per core: 2 >>>> Core(s) per socket: 2 >>>> Socket(s): 1 >>>> NUMA node(s): 1 >>>> Vendor ID: GenuineIntel >>>> CPU family: 6 >>>> Model: 62 >>>> Model name: Intel(R) Xeon(R) CPU @ 2.50GHz >>>> Stepping: 4 >>>> CPU MHz: 2500.000 >>>> BogoMIPS: 5000.00 >>>> Hypervisor vendor: KVM >>>> Virtualization type: full >>>> L1d cache: 32K >>>> L1i cache: 32K >>>> L2 cache: 256K >>>> L3 cache: 30720K >>>> NUMA node0 CPU(s): 0-3 >>>> >>>> > mpirun --version >>>> mpirun (Open MPI) 1.8.1 >>>> >>>> Report bugs to http://www.open-mpi.org/community/help/ >>>> >>>> > mpirun --report-bindings -np 2 echo "hello world" >>>> hello world >>>> [instance-1:03337] MCW rank 1 bound to socket 0[core 1[hwt 0-1]]: >>>> [../BB] >>>> [instance-1:03337] MCW rank 0 bound to socket 0[core 0[hwt 0-1]]: >>>> [BB/..] >>>> hello world >>>> >>>> > mpirun --report-bindings -np 2 python -c 'print " Hello " ' >>>> [instance-1:03341] MCW rank 1 bound to socket 0[core 1[hwt 0-1]]: >>>> [../BB] >>>> [instance-1:03341] MCW rank 0 bound to socket 0[core 0[hwt 0-1]]: >>>> [BB/..] >>>> Hello >>>> Hello >>>> >>>> > mpirun --report-bindings -np 2 python --version >>>> [instance-1:03345] MCW rank 1 bound to socket 0[core 1[hwt 0-1]]: >>>> [../BB] >>>> [instance-1:03345] MCW rank 0 bound to socket 0[core 0[hwt 0-1]]: >>>> [BB/..] >>>> Python 2.7.8 >>>> Python 2.7.8 >>>> >>>> > mpirun --report-bindings -np 2 /usr/bin/env python --version >>>> [instance-1:03349] MCW rank 1 bound to socket 0[core 1[hwt 0-1]]: >>>> [../BB] >>>> [instance-1:03349] MCW rank 0 bound to socket 0[core 0[hwt 0-1]]: >>>> [BB/..] >>>> Python 2.7.8 >>>> Python 2.7.8 >>>> >>>> Testing python, mpi4py and mpirun >>>> Python 2.7.8 >>>> Python 2.7.8 >>>> 2.0.0 >>>> Mpi4py 2.0.0 process 0 of 2 on instance-1. >>>> Mpi4py 2.0.0 process 1 of 2 on instance-1. >>>> >>>> -------- >>>> >>>> [tlinnet@instance-1 ~]$ mpirun --np 2 relax_4.0.2 --multi='mpi4py' >>>> --version >>>> relax 4.0.2 >>>> >>>> >>>> >>>> >>>> >>>> 2016-10-03 12:39 GMT+02:00 Troels Emtekær Linnet <tlin...@nmr-relax.com >>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>>: >>>> >>>>> Hi Sam. >>>>> >>>>> The commands reflect the BASH shell and not TCSH. >>>>> Thats why there i a little difference. >>>>> >>>>> Can you display your login script?: >>>>> >>>>> One of these should be the right one. >>>>> cat $HOME/.cshrc >>>>> cat $HOME/.login, >>>>> cat $HOME/.tcshrc >>>>> >>>>> >>>>> >>>>> >>>>> >>>>> 2016-10-03 1:50 GMT+02:00 Mahdi, Sam <sam.mahdi....@my.csun.edu >>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >>>>> >>>>>> Hi Troels, >>>>>> >>>>>> Here is the output >>>>>> source openmpi_test_install.sh >>>>>> http://svn.gna.org/viewcvs/*checkout*/relax/trunk/devel_scri >>>>>> pts/openmpi_test_install.sh >>>>>> Source the commands with: source openmpi_test_install.sh >>>>>> Then do: testopenmpi >>>>>> >>>>>> function: Command not found. >>>>>> This is functions to test openmpi, python and openmpi. >>>>>> >>>>>> Shell is: /bin/tcsh >>>>>> >>>>>> > which mpirun >>>>>> mpirun: Command not found. >>>>>> >>>>>> > module avail >>>>>> >>>>>> ------------------------ /usr/share/Modules/modulefiles >>>>>> ------------------------ >>>>>> dot module-git module-info modules null use.own >>>>>> >>>>>> ------------------------------- /etc/modulefiles >>>>>> ------------------------------- >>>>>> mpi/mpich-x86_64 mpi/openmpi-x86_64 mpich-x86_64 >>>>>> >>>>>> > lscpu >>>>>> Architecture: x86_64 >>>>>> CPU op-mode(s): 32-bit, 64-bit >>>>>> Byte Order: Little Endian >>>>>> CPU(s): 8 >>>>>> On-line CPU(s) list: 0-7 >>>>>> Thread(s) per core: 2 >>>>>> Core(s) per socket: 4 >>>>>> Socket(s): 1 >>>>>> NUMA node(s): 1 >>>>>> Vendor ID: GenuineIntel >>>>>> CPU family: 6 >>>>>> Model: 58 >>>>>> Model name: Intel(R) Core(TM) i7-3770S CPU @ 3.10GHz >>>>>> Stepping: 9 >>>>>> CPU MHz: 3653.640 >>>>>> CPU max MHz: 3900.0000 >>>>>> CPU min MHz: 1600.0000 >>>>>> BogoMIPS: 6186.25 >>>>>> Virtualization: VT-x >>>>>> L1d cache: 32K >>>>>> L1i cache: 32K >>>>>> L2 cache: 256K >>>>>> L3 cache: 8192K >>>>>> NUMA node0 CPU(s): 0-7 >>>>>> >>>>>> > mpirun --version >>>>>> mpirun: Command not found. >>>>>> >>>>>> > mpirun --report-bindings -np 2 echo "hello world" >>>>>> mpirun: Command not found. >>>>>> >>>>>> A=": Command not found. >>>>>> A: Undefined variable. >>>>>> >>>>>> >>>>>> The reason the mpi commands didn't work, is becaues openmpi was not >>>>>> loaded. I modified your script (added: module load mpi/openmpi-x86_64) >>>>>> and >>>>>> then got this output >>>>>> >>>>>> source openmpi_test_install.sh >>>>>> http://svn.gna.org/viewcvs/*checkout*/relax/trunk/devel_scri >>>>>> pts/openmpi_test_install.sh >>>>>> Source the commands with: source openmpi_test_install.sh >>>>>> Then do: testopenmpi >>>>>> >>>>>> function: Command not found. >>>>>> This is functions to test openmpi, python and openmpi. >>>>>> >>>>>> Shell is: /bin/tcsh >>>>>> >>>>>> > which mpirun >>>>>> /usr/lib64/openmpi/bin/mpirun >>>>>> >>>>>> > module avail >>>>>> >>>>>> ------------------------------------ /usr/share/Modules/modulefiles >>>>>> ------------------------------------ >>>>>> dot module-git module-info modules null use.own >>>>>> >>>>>> ------------------------------------------- /etc/modulefiles >>>>>> ------------------------------------------- >>>>>> mpi/mpich-x86_64 mpi/openmpi-x86_64 mpich-x86_64 >>>>>> >>>>>> > lscpu >>>>>> Architecture: x86_64 >>>>>> CPU op-mode(s): 32-bit, 64-bit >>>>>> Byte Order: Little Endian >>>>>> CPU(s): 8 >>>>>> On-line CPU(s) list: 0-7 >>>>>> Thread(s) per core: 2 >>>>>> Core(s) per socket: 4 >>>>>> Socket(s): 1 >>>>>> NUMA node(s): 1 >>>>>> Vendor ID: GenuineIntel >>>>>> CPU family: 6 >>>>>> Model: 58 >>>>>> Model name: Intel(R) Core(TM) i7-3770S CPU @ 3.10GHz >>>>>> Stepping: 9 >>>>>> CPU MHz: 3733.320 >>>>>> CPU max MHz: 3900.0000 >>>>>> CPU min MHz: 1600.0000 >>>>>> BogoMIPS: 6186.25 >>>>>> Virtualization: VT-x >>>>>> L1d cache: 32K >>>>>> L1i cache: 32K >>>>>> L2 cache: 256K >>>>>> L3 cache: 8192K >>>>>> NUMA node0 CPU(s): 0-7 >>>>>> >>>>>> > mpirun --version >>>>>> mpirun (Open MPI) 1.7.3 >>>>>> >>>>>> Report bugs to http://www.open-mpi.org/community/help/ >>>>>> >>>>>> > mpirun --report-bindings -np 2 echo "hello world" >>>>>> hello world >>>>>> hello world >>>>>> >>>>>> A=": Command not found. >>>>>> A: Undefined variable. >>>>>> >>>>>> As to why the report bindings on python didn't work. I don't know >>>>>> what the A command means, so I don't know what happened there. >>>>>> >>>>>> Sincerely, >>>>>> Sam >>>>>> >>>>>> >>>>>> On Sun, Oct 2, 2016 at 4:16 PM, Troels Emtekær Linnet < >>>>>> tlin...@nmr-relax.com >>>>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> wrote: >>>>>> >>>>>>> Hi Sam. >>>>>>> >>>>>>> Can you try this in your terminal. >>>>>>> I am trying to write a script, which should check at users setup >>>>>>> mpirun. >>>>>>> >>>>>>> -- >>>>>>> >>>>>>> URL=http://svn.gna.org/viewcvs/*checkout*/relax/trunk/devel_ >>>>>>> scripts/openmpi_test_install.sh >>>>>>> wget $URL >>>>>>> >>>>>>> # Source functions >>>>>>> source openmpi_test_install.sh >>>>>>> testopenmpi >>>>>>> >>>>>>> 2016-10-01 0:22 GMT+02:00 Troels Emtekær Linnet < >>>>>>> tlin...@nmr-relax.com >>>>>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>>: >>>>>>> >>>>>>>> Hi Sam. >>>>>>>> >>>>>>>> Can you try: >>>>>>>> mpirun --version >>>>>>>> >>>>>>>> Thanks >>>>>>>> >>>>>>>> 2016-10-01 0:00 GMT+02:00 Mahdi, Sam <sam.mahdi....@my.csun.edu >>>>>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >>>>>>>> >>>>>>>>> Hi Troels, >>>>>>>>> >>>>>>>>> Here is a list of the packages I got off of the fedora package list >>>>>>>>> Openmpi: >>>>>>>>> openmpi-1.7.3-1.fc.20(64-bit) >>>>>>>>> openmpi-devel-1.7.3-1.fc20(64bit) >>>>>>>>> pypar-openmpi-2.1.5_108_3.fc.20(64bit) >>>>>>>>> python3-mpi4py-1.3.1-1.fc20(64bit) >>>>>>>>> >>>>>>>>> Mpi4py >>>>>>>>> mpi4py-common-1.3.1-1.fc20 >>>>>>>>> mpi4py-mpich-1.3.1-1.fc20 >>>>>>>>> mpi4py-openmpi-1.3.1-1.fc20 >>>>>>>>> python3-mpi4py-mpich-1.3.1-1.fc20 >>>>>>>>> python3-mpi4py-openmpi-1.3.1-1.fc20 >>>>>>>>> >>>>>>>>> Note: I now know the mpich is extra and pointless. I only use the >>>>>>>>> openmpi when I load my modules. I have not compiled or configured >>>>>>>>> anything >>>>>>>>> with these packages. I just installed them directly from the package >>>>>>>>> list. >>>>>>>>> If you need any more info on what is installed on these computers let >>>>>>>>> me >>>>>>>>> know! >>>>>>>>> >>>>>>>>> Sincerely, >>>>>>>>> Sam >>>>>>>>> >>>>>>>>> >>>>>>>>> On Fri, Sep 30, 2016 at 2:23 PM, Troels Emtekær Linnet < >>>>>>>>> tlin...@nmr-relax.com >>>>>>>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> wrote: >>>>>>>>> >>>>>>>>>> Hi Sam. >>>>>>>>>> >>>>>>>>>> I am trying to setup myself on Google Cloud Platform. >>>>>>>>>> >>>>>>>>>> Here I setting up for a Redhat 6 distro, in hope it gets close to >>>>>>>>>> Fedora 20. >>>>>>>>>> >>>>>>>>>> I am currently making a deployment script. >>>>>>>>>> >>>>>>>>>> The process is written here: >>>>>>>>>> http://wiki.nmr-relax.com/Run_relax_at_Google_Cloud_Computin >>>>>>>>>> g#Install_packages_at_server >>>>>>>>>> >>>>>>>>>> But that is a little old, since the configurations has changed a >>>>>>>>>> little since 2015. >>>>>>>>>> And the last deployment script is for Ubuntu. >>>>>>>>>> >>>>>>>>>> Getting the packages right is a pain.... ;) >>>>>>>>>> >>>>>>>>>> Let me return when I know some more. >>>>>>>>>> >>>>>>>>>> >>>>>>>>>> >>>>>>>>>> 2016-09-30 23:03 GMT+02:00 Mahdi, Sam <sam.mahdi....@my.csun.edu >>>>>>>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >>>>>>>>>> >>>>>>>>>>> Hi Troels, >>>>>>>>>>> >>>>>>>>>>> I attempted the full path >>>>>>>>>>> mpirun -np 5 ~/relax-4.0.2/relax --multi="mpi4py" -v >>>>>>>>>>> and still got the same result. No output. >>>>>>>>>>> >>>>>>>>>>> Sincerely, >>>>>>>>>>> Sam >>>>>>>>>>> >>>>>>>>>>> On Fri, Sep 30, 2016 at 11:43 AM, Troels Emtekær Linnet < >>>>>>>>>>> tlin...@nmr-relax.com >>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> wrote: >>>>>>>>>>> >>>>>>>>>>>> Hi Sam. >>>>>>>>>>>> >>>>>>>>>>>> Hm. Alright. >>>>>>>>>>>> >>>>>>>>>>>> But to rule it out in my head, can you try this: >>>>>>>>>>>> >>>>>>>>>>>> mpirun -np 5 /home/users/software/relax-4.0.2/relax >>>>>>>>>>>> --multi="mpi4py" -v >>>>>>>>>>>> >>>>>>>>>>>> Or similar destination path. >>>>>>>>>>>> But please try the full path. >>>>>>>>>>>> >>>>>>>>>>>> Best >>>>>>>>>>>> Troels >>>>>>>>>>>> >>>>>>>>>>>> 2016-09-30 19:47 GMT+02:00 Mahdi, Sam < >>>>>>>>>>>> sam.mahdi....@my.csun.edu >>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >>>>>>>>>>>> >>>>>>>>>>>>> I get the same results with the full path mpirun -np 5 >>>>>>>>>>>>> ~/relax-4.0.2/relax --multi="mpi4py" -v >>>>>>>>>>>>> Still no output. >>>>>>>>>>>>> >>>>>>>>>>>>> Sincerely, >>>>>>>>>>>>> Sam >>>>>>>>>>>>> >>>>>>>>>>>>> On Fri, Sep 30, 2016 at 10:39 AM, Troels Emtekær Linnet < >>>>>>>>>>>>> tlin...@nmr-relax.com >>>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','tlin...@nmr-relax.com');>> >>>>>>>>>>>>> wrote: >>>>>>>>>>>>> >>>>>>>>>>>>>> Sam. >>>>>>>>>>>>>> >>>>>>>>>>>>>> All points to: >>>>>>>>>>>>>> "./relax" is NOT calling relax in the current folder. >>>>>>>>>>>>>> >>>>>>>>>>>>>> It is because the command "mpirun" is running it. >>>>>>>>>>>>>> >>>>>>>>>>>>>> Please provide the FULL path to relax. >>>>>>>>>>>>>> >>>>>>>>>>>>>> I think I have written this before. ;) >>>>>>>>>>>>>> >>>>>>>>>>>>>> Best >>>>>>>>>>>>>> Troels >>>>>>>>>>>>>> >>>>>>>>>>>>>> >>>>>>>>>>>>>> 2016-09-30 19:24 GMT+02:00 Mahdi, Sam < >>>>>>>>>>>>>> sam.mahdi....@my.csun.edu >>>>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>>: >>>>>>>>>>>>>> >>>>>>>>>>>>>>> Sorry, you're right, I re-ran the mpirun -np 5 ./relax >>>>>>>>>>>>>>> --multi="mpi4py" -v >>>>>>>>>>>>>>> and got no output. So I'm just curious for the other >>>>>>>>>>>>>>> computers I download >>>>>>>>>>>>>>> openmpi in, just installing it and compiling it isn't >>>>>>>>>>>>>>> enough? There are >>>>>>>>>>>>>>> some configurations you have to make to have it run on relax? >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> Sincerely, >>>>>>>>>>>>>>> Sam >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> On Fri, Sep 30, 2016 at 10:17 AM, Edward d'Auvergne < >>>>>>>>>>>>>>> edw...@nmr-relax.com >>>>>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','edw...@nmr-relax.com');>> >>>>>>>>>>>>>>> wrote: >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> > On 30 September 2016 at 19:12, Mahdi, Sam < >>>>>>>>>>>>>>> sam.mahdi....@my.csun.edu >>>>>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','sam.mahdi....@my.csun.edu');>> >>>>>>>>>>>>>>> > wrote: >>>>>>>>>>>>>>> > > Hi Edward, >>>>>>>>>>>>>>> > > >>>>>>>>>>>>>>> > > So I ran the the mpirun commands you suggested. The echo >>>>>>>>>>>>>>> world works >>>>>>>>>>>>>>> > fine. I >>>>>>>>>>>>>>> > > get the same results you did. For the relax one, this is >>>>>>>>>>>>>>> the output I >>>>>>>>>>>>>>> > > recieved >>>>>>>>>>>>>>> > > [~/relax-4.0.2]> mpirun -np 5 ./relax --multi="mpi4py" >>>>>>>>>>>>>>> -v relax 4.0.2 >>>>>>>>>>>>>>> > > Usage: relax [options] [script_file] >>>>>>>>>>>>>>> > > >>>>>>>>>>>>>>> > > RelaxError: incorrect number of arguments >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Have a close look at my original text: >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > [edward@localhost ~]$ mpirun -np 5 >>>>>>>>>>>>>>> /data/relax/tags/4.0.2/relax >>>>>>>>>>>>>>> > --multi="mpi4py" -v >>>>>>>>>>>>>>> > relax 4.0.2 >>>>>>>>>>>>>>> > [edward@localhost ~]$ >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Note how "relax 4.0.2" is on a different line - that is >>>>>>>>>>>>>>> the relax >>>>>>>>>>>>>>> > output, not the command line input. Try again without >>>>>>>>>>>>>>> that text. >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > > RelaxError: ambiguous option: --v (--verification-tests, >>>>>>>>>>>>>>> --version?) >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > This is because the double-dash to single-dash conversion >>>>>>>>>>>>>>> is only in >>>>>>>>>>>>>>> > the HTML version of the relax manual, and not emails. Run >>>>>>>>>>>>>>> "relax -h" >>>>>>>>>>>>>>> > to see a description of this option. >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > > Also, the reason its ./relax is because I have relax >>>>>>>>>>>>>>> 2.2.5 installed, >>>>>>>>>>>>>>> > and I >>>>>>>>>>>>>>> > > have that set up as an Alias, so if I just type relax, >>>>>>>>>>>>>>> it'll open up >>>>>>>>>>>>>>> > relax >>>>>>>>>>>>>>> > > 2.2.5. So I went to the actual relax-4.0.2. directory >>>>>>>>>>>>>>> instead of >>>>>>>>>>>>>>> > indicating >>>>>>>>>>>>>>> > > its path and just typed ./relax. (By I, I mean the >>>>>>>>>>>>>>> administrator of this >>>>>>>>>>>>>>> > > computer, I do not have root access to this computer). >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > You should set your alias to the relax-4.0.2 version >>>>>>>>>>>>>>> instead. The >>>>>>>>>>>>>>> > 2.2.5 version is very, very old, and many bugs have been >>>>>>>>>>>>>>> fixed since >>>>>>>>>>>>>>> > then. >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Regards, >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Edward >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> _______________________________________________ >>>>>>>>>>>>>>> relax (http://www.nmr-relax.com) >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> This is the relax-users mailing list >>>>>>>>>>>>>>> relax-users@gna.org >>>>>>>>>>>>>>> <javascript:_e(%7B%7D,'cvml','relax-users@gna.org');> >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> To unsubscribe from this list, get a password >>>>>>>>>>>>>>> reminder, or change your subscription options, >>>>>>>>>>>>>>> visit the list information page at >>>>>>>>>>>>>>> https://mail.gna.org/listinfo/relax-users >>>>>>>>>>>>>>> >>>>>>>>>>>>>> >>>>>>>>>>>>>> >>>>>>>>>>>>> >>>>>>>>>>>> >>>>>>>>>>> >>>>>>>>>> >>>>>>>>> >>>>>>>> >>>>>>> >>>>>> >>>>> >>>> >>> >> > _______________________________________________ relax (http://www.nmr-relax.com) This is the relax-users mailing list relax-users@gna.org To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-users