stable
v1.7.0
|
Last change
on this file was c30959, checked in by Frederik Heber <frederik.heber@…>, 5 years ago |
|
BondAddAction also adds to molecule.
- NOTE: This basically does nothing as new atoms (AddAtom action) always get
a dummy molecule. However, removing them from the dummy molecule and readding
one is quite complicated.
- if we add bonds between new atoms (without a molecule set) to and atoms
belonging all to the same molecule, then we automatically add the new atoms
to this molecule as well.
This saves the need for any GraphUpdateMolecules() call afterwards.
- also implemented undo and redo for this.
|
-
Property mode
set to
100644
|
|
File size:
1.4 KB
|
| Line | |
|---|
| 1 | /*
|
|---|
| 2 | * BondAddAction.def
|
|---|
| 3 | *
|
|---|
| 4 | * Created on: Nov 14, 2012
|
|---|
| 5 | * Author: heber
|
|---|
| 6 | */
|
|---|
| 7 |
|
|---|
| 8 | // all includes and forward declarations necessary for non-integral types below
|
|---|
| 9 | #include "types.hpp"
|
|---|
| 10 | #include <vector>
|
|---|
| 11 | #include <utility>
|
|---|
| 12 |
|
|---|
| 13 | typedef std::vector<std::pair<atomId_t,atomId_t> > bondPairIds_t;
|
|---|
| 14 | typedef std::vector<const molecule*> molecules_t;
|
|---|
| 15 |
|
|---|
| 16 | #include "Parameters/Validators/RangeValidator.hpp"
|
|---|
| 17 |
|
|---|
| 18 | // i.e. there is an integer with variable name Z that can be found in
|
|---|
| 19 | // ValueStorage by the token "Z" -> first column: int, Z, "Z"
|
|---|
| 20 | // "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
|
|---|
| 21 | //#define paramtypes (const element *)(BoxVector) TODO: use a validator
|
|---|
| 22 | #define paramtypes (int)
|
|---|
| 23 | #define paramtokens ("bond-degree")
|
|---|
| 24 | #define paramdescriptions ("bond degree of each the added bonds")
|
|---|
| 25 | #define paramreferences (degree)
|
|---|
| 26 | #define paramdefaults (PARAM_DEFAULT(1))
|
|---|
| 27 | #define paramvalids \
|
|---|
| 28 | (RangeValidator<int>(1,10))
|
|---|
| 29 |
|
|---|
| 30 | #define statetypes (bondPairIds_t)(molecules_t)(molecule *)
|
|---|
| 31 | #define statereferences (bondPairIds)(molecules)(add_to_mol)
|
|---|
| 32 |
|
|---|
| 33 | // some defines for all the names, you may use ACTION, STATE and PARAMS
|
|---|
| 34 | #define CATEGORY Bond
|
|---|
| 35 | #define MENUNAME "bond"
|
|---|
| 36 | #define MENUPOSITION 1
|
|---|
| 37 | #define ACTIONNAME Add
|
|---|
| 38 | #define TOKEN "add-bonds"
|
|---|
| 39 |
|
|---|
| 40 | // finally the information stored in the ActionTrait specialization
|
|---|
| 41 | #define DESCRIPTION "add bonds in between any number of selected atoms"
|
|---|
| 42 | #undef SHORTFORM
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
