#include "maloc/maloc.h"
#include "apbs/vhal.h"
#include "apbs/vgrid.h"
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Data Structures | |
| struct | sVmgrid |
| Multiresoltion oracle for Cartesian mesh data. More... | |
Defines | |
| #define | VMGRIDMAX 20 |
Typedefs | |
| typedef sVmgrid | Vmgrid |
| Declaration of the Vmgrid class as the Vgmrid structure. | |
Functions | |
| Vmgrid * | Vmgrid_ctor () |
| Construct Vmgrid object. | |
| int | Vmgrid_ctor2 (Vmgrid *thee) |
| Initialize Vmgrid object. | |
| int | Vmgrid_value (Vmgrid *thee, double x[3], double *value) |
| Get potential value (from mesh or approximation) at a point. | |
| void | Vmgrid_dtor (Vmgrid **thee) |
| Object destructor. | |
| void | Vmgrid_dtor2 (Vmgrid *thee) |
| FORTRAN stub object destructor. | |
| int | Vmgrid_addGrid (Vmgrid *thee, Vgrid *grid) |
| Add a grid to the hierarchy. | |
| int | Vmgrid_curvature (Vmgrid *thee, double pt[3], int cflag, double *curv) |
| Get second derivative values at a point. | |
| int | Vmgrid_gradient (Vmgrid *thee, double pt[3], double grad[3]) |
| Get first derivative values at a point. | |
| Vgrid * | Vmgrid_getGridByNum (Vmgrid *thee, int num) |
| Get specific grid in hiearchy. | |
| Vgrid * | Vmgrid_getGridByPoint (Vmgrid *thee, double pt[3]) |
| Get grid in hiearchy which contains specified point or VNULL. | |
* * APBS -- Adaptive Poisson-Boltzmann Solver * * Nathan A. Baker (baker@biochem.wustl.edu) * Dept. of Biochemistry and Molecular Biophysics * Center for Computational Biology * Washington University in St. Louis * * Additional contributing authors listed in the code documentation. * * Copyright (c) 2002-2005. Washington University in St. Louis. * All Rights Reserved. * Portions Copyright (c) 1999-2002. The Regents of the University of * California. * Portions Copyright (c) 1995. Michael Holst. * * This file is part of APBS. * * APBS is free software; you can redistribute it and/or modify * it under the terms of the GNU General Public License as published by * the Free Software Foundation; either version 2 of the License, or * (at your option) any later version. * * APBS is distributed in the hope that it will be useful, * but WITHOUT ANY WARRANTY; without even the implied warranty of * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the * GNU General Public License for more details. * * You should have received a copy of the GNU General Public License * along with APBS; if not, write to the Free Software * Foundation, Inc., 59 Temple Place, Suite 330, Boston, MA 02111-1307 USA * *
1.3.5