git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3023 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2009-08-08 20:06:53 +00:00
parent efea2a1835
commit eb63ce2377
63 changed files with 369 additions and 329 deletions

View File

@ -13,6 +13,7 @@
#include "stdlib.h"
#include "string.h"
#include "ctype.h"
#include "force.h"
#include "atom.h"
#include "comm.h"
@ -460,6 +461,42 @@ void Force::bounds(char *str, int nmax, int &nlo, int &nhi)
}
}
/* ----------------------------------------------------------------------
read a floating point value from a string
generate an error if not a legitimate floating point value
called by force fields to check validity of their arguments
------------------------------------------------------------------------- */
double Force::numeric(char *str)
{
int n = strlen(str);
for (int i = 0; i < n; i++) {
if (isdigit(str[i])) continue;
if (str[i] == '-' || str[i] == '.') continue;
if (str[i] == 'e' || str[i] == 'E') continue;
error->all("Expecting floating point argument in input script");
}
return atof(str);
}
/* ----------------------------------------------------------------------
read an integer value from a string
generate an error if not a legitimate integer value
called by force fields to check validity of their arguments
------------------------------------------------------------------------- */
int Force::inumeric(char *str)
{
int n = strlen(str);
for (int i = 0; i < n; i++) {
if (isdigit(str[i]) || str[i] == '-') continue;
error->all("Expecting integer argument in input script");
}
return atoi(str);
}
/* ----------------------------------------------------------------------
memory usage of force classes
------------------------------------------------------------------------- */