[gmx-users] double precision

abhijit kayal kayalabhijitiitd at gmail.com
Fri Aug 28 16:03:10 CEST 2009

I am going to do the normal mode analysis of 1OMB.pdb.For this purpose I
have to run the GROMACS in double precision .For this i went through the
manual and made necessart changes in .mdp file.But when I gave grompp_d it
showed like this
[abhijit at SCFBioServer 1omb]$ grompp_d -v -f em.mdp -c b4em.gro -o em.tpr -p
-bash: grompp_d: command not found.
                 I am using GROMACS 4.0.4 version .So my question is why it
showed like this.

Thank you

Abhijit Kayal

IIT Delhi
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