| 1 | /*
|
|---|
| 2 | * PairCorrelationAction.def
|
|---|
| 3 | *
|
|---|
| 4 | * Created on: Aug 25, 2010
|
|---|
| 5 | * Author: heber
|
|---|
| 6 | */
|
|---|
| 7 |
|
|---|
| 8 | // all includes and forward declarations necessary for non-integral types below
|
|---|
| 9 | #include <string>
|
|---|
| 10 | #include <vector>
|
|---|
| 11 | class element;
|
|---|
| 12 |
|
|---|
| 13 | #include "Parameters/Validators/DummyValidator.hpp"
|
|---|
| 14 | #include "Parameters/Validators/Ops_Validator.hpp"
|
|---|
| 15 | #include "Parameters/Validators/STLVectorValidator.hpp"
|
|---|
| 16 | #include "Parameters/Validators/Specific/BoxLengthValidator.hpp"
|
|---|
| 17 | #include "Parameters/Validators/Specific/ElementValidator.hpp"
|
|---|
| 18 | #include "Parameters/Validators/Specific/FilePresentValidator.hpp"
|
|---|
| 19 |
|
|---|
| 20 | #include "Parameters/Validators/DummyValidator.hpp"
|
|---|
| 21 |
|
|---|
| 22 | // i.e. there is an integer with variable name Z that can be found in
|
|---|
| 23 | // ValueStorage by the token "Z" -> first column: int, Z, "Z"
|
|---|
| 24 | // "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
|
|---|
| 25 | #define paramtypes (std::vector<const element *>)(double)(double)(double)(boost::filesystem::path)(boost::filesystem::path)(bool)
|
|---|
| 26 | #define paramreferences (elements)(BinStart)(BinWidth)(BinEnd)(outputname)(binoutputname)(periodic)
|
|---|
| 27 | #define paramtokens ("elements")("bin-start")("bin-width")("bin-end")("output-file")("bin-output-file")("periodic")
|
|---|
| 28 | #define paramdescriptions ("set of elements")("start of the first bin")("width of the bins")("start of the last bin")("name of the output file")("name of the bin output file")("system is constraint to periodic boundary conditions")
|
|---|
| 29 | #define paramdefaults (NOPARAM_DEFAULT)(NOPARAM_DEFAULT)(PARAM_DEFAULT(0.5))(NOPARAM_DEFAULT)(NOPARAM_DEFAULT)(NOPARAM_DEFAULT)(PARAM_DEFAULT(false))
|
|---|
| 30 | #define paramvalids \
|
|---|
| 31 | (STLVectorValidator< std::vector<const element *> >(1,2, ElementValidator())) \
|
|---|
| 32 | (BoxLengthValidator()) \
|
|---|
| 33 | (BoxLengthValidator()) \
|
|---|
| 34 | (BoxLengthValidator()) \
|
|---|
| 35 | (!FilePresentValidator()) \
|
|---|
| 36 | (!FilePresentValidator()) \
|
|---|
| 37 | (DummyValidator<bool>())
|
|---|
| 38 |
|
|---|
| 39 | // some defines for all the names, you may use ACTION, STATE and PARAMS
|
|---|
| 40 | #define CATEGORY Analysis
|
|---|
| 41 | #define MENUNAME "analysis"
|
|---|
| 42 | #define MENUPOSITION 2
|
|---|
| 43 | #define ACTIONNAME PairCorrelation
|
|---|
| 44 | #define TOKEN "pair-correlation"
|
|---|
| 45 |
|
|---|
| 46 | // finally the information stored in the ActionTrait specialization
|
|---|
| 47 | #define DESCRIPTION "pair correlation analysis between all atoms of two given elements, or between the selected atoms and the atoms of the single given element"
|
|---|
| 48 | #define SHORTFORM "C"
|
|---|
