4 * This source code is part of
8 * GROningen MAchine for Chemical Simulations
12 * Copyright (c) 1991-2001
13 * BIOSON Research Institute, Dept. of Biophysical Chemistry
14 * University of Groningen, The Netherlands
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34 * Good ROcking Metal Altar for Chronical Sinners
40 static char *SRCID_do_md_h = "$Id$";
46 #ident "@(#) do_md.h 1.16 2/2/97"
47 #endif /* HAVE_IDENT */
54 extern time_t do_md(FILE *log,t_commrec *cr,int nfile,t_filenm fnm[],
55 bool bVerbose,bool bCompact,int stepout,
56 t_parm *parm,t_groups *grps,
57 t_topology *top,real ener[],
58 rvec x[],rvec vold[],rvec v[],rvec vt[],rvec f[],
59 rvec buf[],t_mdatoms *mdatoms,
60 t_nsborder *nsb,t_nrnb nrnb[],