source: src/Actions/AtomAction/SaturateAction.def

stable v1.7.0
Last change on this file was 463bfb, checked in by Frederik Heber <frederik.heber@…>, 2 months ago

FIX: SaturateAction had typo in default.

  • this originated in 2390e63956.
  • Property mode set to 100644
File size: 1.2 KB
Line 
1/*
2 * SaturateAction.def
3 *
4 * Created on: Jan 26, 2015
5 * Author: heber
6 */
7
8// all includes and forward declarations necessary for non-integral types below
9
10#include "Parameters/Validators/DummyValidator.hpp"
11
12// i.e. there is an integer with variable name Z that can be found in
13// ValueStorage by the token "Z" -> first column: int, Z, "Z"
14// "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
15#define paramtypes (bool)
16#define paramtokens ("use-outer-shell")
17#define paramdescriptions ("whether to just look at valencies (false) or take the occupancy of the outer shell into account (true) for the polyhedra")
18#define paramreferences (useOuterShell)
19#define paramdefaults (PARAM_DEFAULT(0))
20#define paramvalids (DummyValidator<bool>())
21
22#define statetypes (std::vector<AtomicInfo>)
23#define statereferences (addedHydrogens)
24
25// some defines for all the names, you may use ACTION, STATE and PARAMS
26#define CATEGORY Atom
27#define MENUNAME "atom"
28#define MENUPOSITION 4
29#define ACTIONNAME Saturate
30#define TOKEN "saturate-atoms"
31
32
33// finally the information stored in the ActionTrait specialization
34#define DESCRIPTION "saturate all selected atoms by adding hydrogens at the typical distance"
35#undef SHORTFORM
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