#ifndef pdbformat_h #define pdbformat_h /** \file pdbformat.h * Header file for \ref pdbformat.c * * Contains declarations of the functions implemented in \ref pdbformat.c * Project: ParallelCarParrinello \author Marcel Arndt 2000 File: pdbformat.h $Id: pdbformat.h,v 1.7 2006/03/30 22:19:51 foo Exp $ */ int WritePDBLine(FILE *f, unsigned id, const char* atomname, const char* residuename, unsigned residuenr, double x, double y, double z, double occupancy, double tempfact, const char* segid, const char* elementsymbol, const char* charge); #endif