Re: [AMBER] problem setting drms to low values

From: Attilio Vittorio Vargiu <attilio.vargiu.gmail.com>
Date: Thu, 8 Dec 2011 11:17:11 -0800

Dear Prof. Case,
thank you for the answer, I will try it.

Concerning the reposting, I am sorry for that.
Before asking again I went to the amber mirror website to check if my
third post
was there and I saw the following:

[AMBER] problem setting drms to low values Attilio Vittorio Vargiu
(Sat Dec 03 2011 - 23:31:53 PST)
    Re: [AMBER] problem setting drms to low values David A Case (Mon
Dec 05 2011 - 05:22:30 PST)
        Re: [AMBER] problem setting drms to low values Attilio
Vittorio Vargiu (Mon Dec 05 2011 - 14:52:21 PST)

so I though for some reason my previous messages were not arrived.
It was not my intention to make pressure, also because I don't have any
right to. Usually I wait 3 or more days before asking.

Thanks again for your help.

Attilio

2011/12/8 David A Case <case.biomaps.rutgers.edu>:
> On Thu, Dec 08, 2011, Attilio Vittorio Vargiu wrote:
>
>> > Error in group input::atommask.f::pop_evalstack
>> > stack underflow
>> >
>> > I tried increasing the maxstack parameter to 768 and later 2560
>> > (originally was 256)
>
> You also must change the size of the restraintmask string in md.h.  See if
> that helps.
>
> (Generally, people on the list provide answers as they have time and knowledge
> to do so.  It is generally not a good policy to repost at frequent intervals
> just based on a lack of response.)
>
> ...dac
>
>
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber



-- 
¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤
                  Attilio Vittorio Vargiu, PhD
   SLACS & Department of Physics, University of Cagliari
  Cittadella Universitaria S.P. Monserrato-Sestu Km 0.700
               09042 Monserrato (CA), Italy
             e-mail1: vargiu.dsf.unica.it
             e-mail2: attilio.vargiu.gmail.com
             Phone: +390706754847
             Fax: +39070510171
¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤¤
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Dec 08 2011 - 11:30:03 PST
Custom Search