[R] Using R to format a file using a server (PDB to PQR file)

Dieter Menne dieter.menne at menne-biomed.de
Wed Feb 10 08:58:31 CET 2010



Amitoj S. Chopra wrote:
> 
> I am trying to write a program that uses R and takes a pdb file, and
> converts it to a pqr file. This task is simple generally, using the
> website, http://pdb2pqr-1.wustl.edu/pdb2pqr/. How do you use R to input a
> pdb file (that is on hand) into the upload pdb file input, and run the
> website and give the return file to be a pqr file.
> 

Try Curl

http://curl.haxx.se/

and the RCurl package. It not complicated, but can be a lot of work in
detail.

Dieter


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