[gmx-users] error in converting charmm to gromacs

Chanchal chanchal.kar at gmail.com
Sat Nov 21 01:10:38 CET 2009


Hi All,
    I want to create ffcharmm*.itp file from par_all36_carb.prm using the
script provided by Mark Abraham. While I used execute the command ./
convert_charmm_to_gromacs.pl par_all36_carb.prm , I got this message:
Argument "CTOFNB" isn't numeric in multiplication (*) at ./
convert_charmm_to_gromacs.pl line 270, <GEN0> line 1382.
Argument "EPS" isn't numeric in multiplication (*) at ./
convert_charmm_to_gromacs.pl line 279, <GEN0> line 1382.

How can I fix this error?
Thanks
Chanchal
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