/usr/include/gromacs/tables.h is in gromacs-dev 4.6.5-1build1.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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* This file is part of the GROMACS molecular simulation package.
*
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* check out http://www.gromacs.org for more information.
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#ifndef _tables_h
#define _tables_h
#include "visibility.h"
#ifdef __cplusplus
extern "C" {
#endif
#if 0
}
#endif
GMX_LIBMD_EXPORT
void table_spline3_fill_ewald_lr(real *table_F,
real *table_V,
real *table_FDV0,
int ntab,
real dx,
real beta);
/* Fill tables of ntab points with spacing dr with the ewald long-range
* (mesh) force.
* There are three separate tables with format FDV0, F, and V.
* This function interpolates the Ewald mesh potential contribution
* with coefficient beta using a quadratic spline.
* The force can then be interpolated linearly.
*/
real ewald_spline3_table_scale(real ewaldcoeff, real rc);
/* Return the scaling for the Ewald quadratic spline tables. */
#ifdef __cplusplus
}
#endif
#endif /* _tables\_h */
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