ESPResSo
Extensible Simulation Package for Research on Soft Matter Systems
Loading...
Searching...
No Matches
bonds.cpp
Go to the documentation of this file.
1
/*
2
* Copyright (C) 2025 The ESPResSo project
3
*
4
* This file is part of ESPResSo.
5
*
6
* ESPResSo is free software: you can redistribute it and/or modify
7
* it under the terms of the GNU General Public License as published by
8
* the Free Software Foundation, either version 3 of the License, or
9
* (at your option) any later version.
10
*
11
* ESPResSo is distributed in the hope that it will be useful,
12
* but WITHOUT ANY WARRANTY; without even the implied warranty of
13
* MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
14
* GNU General Public License for more details.
15
*
16
* You should have received a copy of the GNU General Public License
17
* along with this program. If not, see <http://www.gnu.org/licenses/>.
18
*/
19
20
#include "
cell_system/CellStructure.hpp
"
21
#include "system/System.hpp"
22
23
#include <vector>
24
25
bool
add_bond
(
System::System
&system,
int
bond_id,
26
std::vector<int>
const
&particle_ids) {
27
Particle
*p = system.
cell_structure
->get_local_particle(particle_ids[0]);
28
if
(p) {
29
// The bond view is stored in the bond list of the primary particle.
30
// Thus the bond views's partner list only contains the other particle id.
31
BondView
bond(bond_id, {particle_ids.data() + 1, particle_ids.size() - 1});
32
p->
bonds
().insert(bond);
33
return
true
;
34
}
35
return
false
;
36
}
CellStructure.hpp
add_bond
bool add_bond(System::System &system, int bond_id, std::vector< int > const &particle_ids)
Add a bond to a particle.
Definition
bonds.cpp:25
BondView
Immutable view on a bond.
Definition
BondList.hpp:44
System::System
Main system class.
Definition
core/system/System.hpp:77
System::System::cell_structure
std::shared_ptr< CellStructure > cell_structure
Definition
core/system/System.hpp:296
Particle
Struct holding all information for one particle.
Definition
Particle.hpp:395
Particle::bonds
auto const & bonds() const
Definition
Particle.hpp:428
src
core
bonds.cpp
Generated on Wed Mar 12 2025 02:15:18 for ESPResSo by
1.9.8