[gmx-users] PBS script

KS Rotondi ksr at chemistry.umass.edu
Mon Sep 13 01:27:45 CEST 2010


I apologize to all for this, as I meant it to be a single reply; but  
as someone who has quietly watched the soon Dr. Lemkul bust his chops  
providing first class advice/assistance to any and all, usually w/in  
15 min, everyday for years, I could not abide someone suggesting less  
than complete commitment to help on Justin's part.

KSR

On Sep 12, 2010, at 6:27 PM, KS Rotondi wrote:

> it must be hard to do your own research
>
> On Sep 12, 2010, at 5:52 PM, manoj singh wrote:
>
>> Thanks for reminding me the existence of Google.
>> It must be hard to copy and paste few lines of the PBS script than  
>> advertising the Google.
>>
>> On Sun, Sep 12, 2010 at 5:23 PM, Justin A. Lemkul <jalemkul at vt.edu>  
>> wrote:
>>
>>
>> manoj singh wrote:
>> Thanks for the reply!
>>
>> I will be very thankful if you can send me whatever you have.
>>
>> I will change that according to my system.
>>
>>
>> If you know enough to make changes, then you probably know enough  
>> to get up and running.  A Google search for "example PBS script"  
>> turns up nearly 4 million results, the first of which contains much  
>> of the necessary basic information.
>>
>> -Justin
>>
>>
>>
>> On Sun, Sep 12, 2010 at 5:09 PM, Justin A. Lemkul <jalemkul at vt.edu <mailto:jalemkul at vt.edu 
>> >> wrote:
>>
>>
>>
>>    manoj singh wrote:
>>
>>        Hi,
>>
>>        I will be very thankful if someone can share a sample pbs  
>> script
>>        for running Gromacs-4.5.
>>
>>
>>    Contact your system admins.  There are far too many variables for
>>    such a setup for anyone here to send such information.
>>
>>    -Justin
>>
>>        Thanks!
>>
>>
>>    --     ========================================
>>
>>    Justin A. Lemkul
>>    Ph.D. Candidate
>>    ICTAS Doctoral Scholar
>>    MILES-IGERT Trainee
>>    Department of Biochemistry
>>    Virginia Tech
>>    Blacksburg, VA
>>    jalemkul[at]vt.edu <http://vt.edu> | (540) 231-9080
>>
>>    http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>>
>>    ========================================
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>>
>> -- 
>> ========================================
>>
>> Justin A. Lemkul
>> Ph.D. Candidate
>> ICTAS Doctoral Scholar
>> MILES-IGERT Trainee
>> Department of Biochemistry
>> Virginia Tech
>> Blacksburg, VA
>> jalemkul[at]vt.edu | (540) 231-9080
>> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>>
>> ========================================
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