Hi Edward,

Have you tried just editing the short command script on a text editor so you 
keep the formatting. You could also try the full path for the executable and 
the lib files while you are at it.

I have a problem of a different nature. I get get the example data file to work 
but no other file seems to work. I have tried editing other pdb  files to make 
them look more like the example pdb but none seems to work. I get an error 
message in the .lis file which reads;
Base atom C1* missing in strand 2 level 1 (Necessary for analysis). I have 
gotten the same error with a few files from the NDB and PDB as well as with 
mine. Any suggestions on how to solve this problem will be highly appreciated.

Raymond.
________________________________________
From: CCP4 bulletin board [[email protected]] On Behalf Of KAMESH 
Narasimhan [[email protected]]
Sent: Friday, February 04, 2011 4:44 AM
To: [email protected]
Subject: Re: [ccp4bb] DNA analysis with Curves+

Try and copy this on your command line and see if it works. The trick is to 
shift first 3 lines by one space.

[xxxxx@zeus ~/curves]$ Cur+ <<!
 &inp file=data/1bna, lis=r+bdna,
 lib=standard, &end
 2 1 -1 0 0
 1:12
 24:13
!

Curves is very handy once you get a hang of how to submit the input. 
Alternatively, I use “3DNA to generate the curves input” --- which is less 
cryptic.


-----Original Message-----
From: CCP4 bulletin board [mailto:[email protected]] On Behalf Of Eddie 
Pryor
Sent: Friday, February 04, 2011 4:05 AM
To: [email protected]
Subject: [ccp4bb] DNA analysis with Curves+

Hi, All,

I am trying to analyze DNA from a recent structure with the program Curves+ (R. 
Lavery et al, Nuc. Acids. Res (2009) 37:17 5917; 
http://gbio-pbil.ibcp.fr/Curves_plus/Curves+.html).  I have downloaded the 
files, and untarred them to a directory "curves" on my machine.  Running the 
Make command on these files yielded no errors, and I have the executable file 
Cur+ in this directory.  I am trying to run this program, first using the 
example data that is provided (the Drew-Dickerson Dodecamer), but am having 
some difficulties.  The resource for Curves gives the following command to run 
the program:

/Users/RL/Code/Cur+ <<!
   &inp file=str/1bna, lis=r+bdna,
   lib=/Users/RL/Code/standard,
   &end
2 1 -1 0 0
1: 12
24:13
!

On my machine, the directory structure is slightly different:
   - the executable Cur+ is in a folder named "curves"
   - the files standard_b.lib and standard_s.lib are also in this folder
   - the pdb file 1bna.pdb is in the subfolder "data"

I have tried to run the program by doing the following:

[xxxxx@zeus ~/curves]$ Cur+ <<!
? &inp file=data/1bna, lis=r+bdna,
? lib=standard, &end
? 2 1 -1 0 0
? 1:12
? 24:13
? !

The question mark prompts appear upon hitting enter after each line.

The only error message I get when I try to run this is:

   ---- Error in namelist input for  ----


I have even tried the following (entering all if the input files on the same 
line):

[xxxxx@zeus ~/curves]$ Cur+ <<! &inp file=data/1bna, lis=r+bdna, lib=standard, 
&end
? 2 1 -1 0 0
? 1:12
? 24:13
? !

Which gives the following errors:
  inp: Command not found
  end: Not in while/foreach
  At line 28 of file nml.f
  Fortran runtime error: End of file

I am hoping that some of you have had success with running this program and can 
offer any advice.  I would really appreciate it!

Thanks!

Edward Pryor
Ph.D. Candidate
Tom Hollis Lab
Department of Biochemistry
Center for Structural Biology
Wake Forest University School of Medicine

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