AMBER Archive (2003)

Subject: Re: using antechamber

From: Pascal Bonnet (pascal.bonnet_at_man.ac.uk)
Date: Tue Mar 18 2003 - 10:36:23 CST

Hi,

I think you have a problem of your environment variables. If you look at
the INSTALL file, it is written:
1. Set up your environment:

    The AMBERHOME environment variable should point to the directory
    you are now in. For example:

    Using csh, tcsh, etc: setenv AMBERHOME /usr/local/amber7

    Using sh, bash, zsh, etc: set AMBERHOME=/usr/local/amber7
                              export AMBERHOME

    NOTE: Be sure to replace the "/usr/local" part above with whatever
    path is appropriate for your machine.

    You may then wish to add $AMBERHOME/exe to your PATH environment
    variable.

To run AMBER, you have to set your environment correctly.
Good luck.

Pascal

Mauro Carlos Costa Ribeiro wrote:
>
> When I follow the AMBER7 Users' Manual example of usage of antechamber:
>
> antechamber -i tp.pdb -fi pdb -o tp.prepin -fo prepi -c bcc
>
> I get the message error:
>
> Cannot open CONNECT.TPL, exit
>
> I see that the CONNECT.TPL exists in the
> /usr/local/amber7/dat/antechamber/ directory. Why is it not open by
> antechamber?
>
> Dr. Mauro C. C. Ribeiro
>
> Instituto de Quimica
> Universidade de Sao Paulo
> Sao Paulo
> Brasil 

-- 
***************************************************
 Dr. Pascal Bonnet
 School of Pharmacy and Pharmaceutical Sciences,
 University of Manchester, Oxford Road,
 Manchester, M13 9PL, U.K
 Tel:(+44) (0)161 275 2431
 http://www.man.ac.uk/~mbpsspb3