charmm27 fatal error

From: Arturas Ziemys (ziemys_at_chbmeng.ohio-state.edu)
Date: Mon Dec 19 2005 - 14:06:00 CST

HI,

I'm new to NAMD (but nor MD). I test NAMD 2.6b1 with 1UBQ tutorial and my own protein in water box.

In all cases I get fatal error (see output below). How can it be explained ?

With best
Arturas

...............................................................
Info: COORDINATE PDB ubq_wb.pdb
Info: STRUCTURE FILE ubq_wb.psf
Info: PARAMETER file: CHARMM format!
Info: PARAMETERS top_all27_prot_lipid.inp
Info: USING ARITHMETIC MEAN TO COMBINE L-J SIGMA PARAMETERS
FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE top_all27_prot_lipid.inp

LINE=*27 1*
------------- Processor 0 Exiting: Called CmiAbort ------------
Reason: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE top_all27_prot_lipid.inp
LINE=*27 1*

Charm++ fatal error:
FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE top_all27_prot_lipid.inp

LINE=*27 1*

abnormal program termination

.................................................................

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 05:19:10 CST