#include <tcl.h>
#include "VMDApp.h"
#include "DrawMolecule.h"
#include "MoleculeList.h"
#include "Timestep.h"
#include "Residue.h"
#include "Inform.h"
#include "utilities.h"
#include "colvarmodule.h"
#include "colvarscript.h"
#include "colvaratoms.h"
#include "colvarproxy.h"
#include "colvarproxy_vmd.h"
Go to the source code of this file.
Enumerations | |||||||||
enum | e_pdb_field { e_pdb_none, e_pdb_occ, e_pdb_beta, e_pdb_x, e_pdb_y, e_pdb_z, e_pdb_ntot } | ||||||||
Functions | |||||||||
int | tcl_run_colvarscript_command (ClientData clientData, Tcl_Interp *interp_in, int objc, Tcl_Obj *const objv[]) | ||||||||
Run the script API via Tcl command-line interface
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int | tcl_colvars (ClientData clientData, Tcl_Interp *interp, int objc, Tcl_Obj *const objv[]) | ||||||||
int | tcl_colvars_vmd_init (Tcl_Interp *interp, int molid_input) | ||||||||
e_pdb_field | pdb_field_str2enum (std::string const &pdb_field_str) | ||||||||
Variables | |||||||||
VMDApp * | colvars_vmd_ptr = NULL | ||||||||
colvarproxy_vmd * | colvarproxy_vmd_ptr = NULL |
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Definition at line 391 of file colvarproxy_vmd.C. Referenced by colvarproxy_vmd::load_atoms, colvarproxy_vmd::load_coords, and pdb_field_str2enum. |
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Definition at line 401 of file colvarproxy_vmd.C. References e_pdb_beta, e_pdb_field, e_pdb_none, e_pdb_occ, e_pdb_x, e_pdb_y, e_pdb_z, colvarmodule::error, and colvarparse::to_lower_cppstr. Referenced by colvarproxy_vmd::load_atoms, and colvarproxy_vmd::load_coords. |
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Definition at line 45 of file colvarproxy_vmd.C. References colvars_vmd_ptr, NULL, and tcl_run_colvarscript_command. |
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Definition at line 56 of file colvarproxy_vmd.C. References colvarproxy_vmd_ptr, colvars_vmd_ptr, colvarmodule::get_error, VMDApp::molecule_top, and VMDApp::molecule_valid_id. |
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Run the script API via Tcl command-line interface
Definition at line 1757 of file colvarscript.C. Referenced by colvarscript::colvarscript. |
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Definition at line 31 of file colvarproxy_vmd.C. Referenced by tcl_colvars_vmd_init. |
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Definition at line 30 of file colvarproxy_vmd.C. Referenced by tcl_colvars, and tcl_colvars_vmd_init. |