hi i m pragya, i found this article .... i used ffG43a1 and got this error when
ran grompp:
Atomtype 'CA' not found! . i m using popc128a.pdb from tieleman site and m
using "lipid.itp"
#include "ffG43a1.itp"#include "lipid.itp"#include "popc.itp"
#ifdef FLEX_SPC#include "flexspc.itp"#else#include "spc.itp"#endif
#ifdef POSRES_WATER; Position restraint for each water oxygen[
position_restraints ]; i funct fcx fcy fcz 1 1
1000 1000 1000#endif
; Include generic topology for ions#include "ions.itp"
[ system ]; NamePure DPPC bilayer with 128 lipids and 3655 water molecules
[ molecules ]; Compound #molsPOPC 128SOL 2460
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