Sorry for duplicate mail, I think my mails are going in spam when I reply or forward
________________________________
From: Jio M <jiomm.yahoo.com>
To: amber <amber.ambermd.org>
Sent: Wednesday, July 25, 2012 4:27 PM
Subject: Re: [AMBER] stripping number of residues (>20K) problem
Dear Daniel Roe,
>>FYI, there is no maximum line length in cpptraj.
Sorry I tested it late.
I was trying to remove those large number of residues as a test. I am getting "segmentation fault" with these number of residues. So, I think, cpptraj has some limit also?, but unlike ptraj, in cpptraj strip command at least can read all residues once but in ACTIONS it mess up with the residue numbers (as seen in attached out file)
in/out files are attached. So I was just thinking is it possible to read all residue numbers in some single array.
regards,
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Jul 25 2012 - 23:00:03 PDT
