[molpro-user] Installation Molpro 2010.1.22

[Andy May]

Artur,

INSTLIB depends on the options you gave configure, you can easily find 
its value with grep, eg.:

Molpro> grep INSTLIB CONFIG
INSTLIB=/usr/local/lib/molpros_2010_2_Linux_x86_64_i8

This directory is created during 'make install'. If you are running 
without make install then the location is simply the build 'lib/' directory.

Best wishes,

Andy

On 30/06/11 09:56, Artur Ukleja wrote:
> Andy,
>
> thanks a lot for answer. But I can not see the directory INSTLIB/ to
> save the license token. Only there are bin/ and lib/ directories. What
> should I do? Should I create INSTLIB directory on the same level as bin/
> and lib/ directories? or save the license token in one of the existing
> directories: bin/ or lib/?
>
> Thanks,
> Artur
>
> On 6/29/11 1:55 PM, Andy May wrote:
>> Artur,
>>
>> The error you see relates to downloading the license token from the
>> Molpro website. It could perhaps be firewall related or wrong
>> credentials, but it is not worth investigating. The easiest way to fix
>> is to manually log in to the website and download the license token
>> from the website and install it in INSTLIB/.token.
>>
>> Best wishes,
>>
>> Andy
>>
>> On 29/06/11 09:49, Artur Ukleja wrote:
>>> Hi Andy,
>>>
>>> thanks a lot for fast answer. I will install new patch but here my
>>> problem was stupid. As first I should install Molpro2010.1 and the patch
>>> 2010.1.22 (or 23) just after. I did know about that and I tried to
>>> install patch 2010.1.22 without Molpro2010.1. I am sorry again but I was
>>> installing of Molpro for the first time and I did know about that.
>>>
>>> May I have now other question for you?
>>>
>>> I got strange info during installation process. One note is that :
>>> Installation of Molpro files complete" and just after new note that:
>>> "Error: Token downloaded unsucessful". Comment is as follows:
>>>
>>> [arturu at wn2079 molpro2010.1]$ make install
>>> make[1]: Entering directory
>>> `/vosoft/plgrid/molpro/molpro2010.1/utilities'
>>> make[1]: Nothing to be done for `default'.
>>> make[1]: Leaving directory
>>> `/vosoft/plgrid/molpro/molpro2010.1/utilities'
>>> ......
>>> make[1]: Leaving directory `/vosoft/plgrid/molpro/molpro2010.1/lib'
>>> make[1]: Entering directory `/vosoft/plgrid/molpro/molpro2010.1'
>>> building local-install.sh.gz
>>> make[1]: Leaving directory `/vosoft/plgrid/molpro/molpro2010.1'
>>> tar: molpros_2010_1_Linux_x86_64_i8.template: time stamp 2011-06-28
>>> 17:45:15 is 153 s in the future
>>> tar: molpros_2010_1_Linux_x86_64_i8.exe: time stamp 2011-06-28 17:45:15
>>> is 152 s in the future
>>>
>>> Installation of Molpro files complete
>>>
>>> Please give your username for accessing molpro
>>> xxxxx
>>>
>>> Please give your password for accessing molpro
>>> xxxxx
>>>
>>> Error: Token downloaded unsucessful
>>> make: *** [install] Error 1
>>> [arturu at wn2079 molpro2010.1]$
>>>
>>>
>>> Do you have idea what means? Is the Molpro2010.1 correctly installed or
>>> not? Should I be in stress due to note: "Error: Token downloaded
>>> unsucessful" or maybe should I ignored if note above says that
>>> "Installation of Molpro files complete"? I checked that the *.exe files
>>> were created in the proper directory.
>>>
>>> Once again thanks a lot. I appreciate your help very much.
>>> Cheers,
>>> Artur
>>>
>>>
>>> On 6/28/11 3:13 PM, Andy May wrote:
>>>> Artur,
>>>>
>>>> The problem has occured building MPICH2, you can hopefully see the
>>>> source of the problem in src/mpich2-1.3.3rc1/make.log.
>>>>
>>>> We are now on Molpro 2010.1.23, so I recommend to use this version of
>>>> Molpro (which now uses MPICH2 1.4).
>>>>
>>>> However, I believe the main source of the problem is likely to be
>>>> GCC/Gfortran 4.1.2. Unfortunately, Gfortran had many bugs in it's
>>>> early versions and could not successfully build Molpro (and probably
>>>> many other applications). I think you need at least GCC/Gfortran 4.3,
>>>> and if you are going to the trouble of installing another GCC/Gfortran
>>>> version I would recommend 4.5.
>>>>
>>>> Best wishes,
>>>>
>>>> Andy
>>>>
>>>> On 28/06/11 12:49, Artur Ukleja wrote:
>>>>> Dear Molpro team,
>>>>>
>>>>> I am trying to install Molpro 2010.1.22 on Scientific Linux CERN SLC
>>>>> release 5.6 (Boron) machine without success.
>>>>>
>>>>> The configuration stuck during "make" command (as I guess). I seems
>>>>> that
>>>>> compilation has started but failed just after called "make".
>>>>>
>>>>> I am using the following command to compile:
>>>>>
>>>>> [arturu at wn2079 Molpro]$ ./configure -batch -gcc -gfortran -mpp
>>>>> -auto-ga-tcgmsg-mpich2 -instroot /vosoft/plgrid/molpro/molpro2010.1.22
>>>>> -noblas -nolapack
>>>>>
>>>>>
>>>>> just after I got following result:
>>>>>
>>>>> [arturu at wn2079 Molpro]$ ./configure -batch -gcc -gfortran -mpp
>>>>> -auto-ga-tcgmsg-mpich2 -instroot /vosoft/plgrid/molpro/molpro2010.1.22
>>>>> -noblas -nolapack
>>>>>
>>>>> machine type recognized as x86_64 (Generic 64-bit)
>>>>> kernel recognized as Linux
>>>>>
>>>>> user request compiler gfortran
>>>>> GNU Fortran Compiler, Version 4.1.2
>>>>> FC=/usr/bin/gfortran
>>>>>
>>>>> user request compiler gcc
>>>>> GNU Compiler Collection, Version 4.1.2
>>>>> CC=/usr/bin/gcc
>>>>>
>>>>> starting auto-build of prerequisites
>>>>>
>>>>> % Total % Received % Xferd Average Speed Time Time Time Current
>>>>> Dload Upload Total Spent Left Speed
>>>>> 100 18.6M 100 18.6M 0 0 3584k 0 0:00:05 0:00:05 --:--:-- 4199k
>>>>>
>>>>> building MPICH2 version 1.3.3rc1, each step could take a few minutes
>>>>>
>>>>> ./configure --prefix=/vosoft/plgrid/molpro/Molpro/src/mpich2-install
>>>>> --with-device=ch3:nemesis --with-pm=hydra --enable-f77
>>>>> F77=/usr/bin/gfortran --enable-fc FC=/usr/bin/gfortran --enable-cc
>>>>> CC=/usr/bin/gcc --enable-cxx CXX=/usr/bin/g++
>>>>> make
>>>>> failed
>>>>>
>>>>> Result so far of configure written to CONFIG.errout
>>>>> [arturu at wn2079 Molpro]$
>>>>>
>>>>>
>>>>> I also attach CONFIG.errout file to this email. Does anybody have any
>>>>> idea how to fix it?
>>>>> Thank you in advance for any suggestions,
>>>>> Artur Ukleja
>>>>>
>>>>>
>>>>>
>>>>> _______________________________________________
>>>>> Molpro-user mailing list
>>>>> Molpro-user at molpro.net
>>>>> http://www.molpro.net/mailman/listinfo/molpro-user
>>>
>
>
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