Fix_FitPartialCharges
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Last change
on this file since eaf08f was 6ba9ba, checked in by Frederik Heber <heber@…>, 13 years ago |
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Default values are properly set by the Action into their (Action)Parameters.
- we changed the boost::preprocessor magic to accomplish this.
- NODEFAULT -> NOPARAM_DEFAULT to be safe.
- it has been a hell of a lot of work to make it possible to add a construct
such as ", default" to the call of a function, either the comma or the
default is easy but both could only be accomplished via a list contained
in the sequence of default values. Because the list has an explicit NIL
element which is taken as NOPARAM_DEFAULT.
- PARAM_DEFAULT is a macro to wrap the default value into a list.
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Property mode
set to
100644
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File size:
1.0 KB
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| [fc192f] | 1 | #undef paramdescriptions
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| [e4afb4] | 2 | #undef paramdefaults
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| [9ee38b] | 3 | /*
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| 4 | * PrincipalAxisSystemAction.def
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| 5 | *
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| 6 | * Created on: Aug 25, 2010
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| 7 | * Author: heber
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| 8 | */
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| 9 |
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| 10 | // all includes and forward declarations necessary for non-integral types below
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| 11 |
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| [649aaa] | 12 | #include "Parameters/Validators/DummyValidator.hpp"
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| 13 |
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| [9ee38b] | 14 | // i.e. there is an integer with variable name Z that can be found in
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| 15 | // ValueStorage by the token "Z" -> first column: int, Z, "Z"
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| [6ba9ba] | 16 | // "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
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| [fc192f] | 17 | #undef paramtypes
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| 18 | #undef paramreferences
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| 19 | #undef paramtokens
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| 20 | #undef paramdescriptions
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| [e4afb4] | 21 | #undef paramdefaults
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| [23958d] | 22 | #undef paramvalids
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| [9ee38b] | 23 |
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| 24 | // some defines for all the names, you may use ACTION, STATE and PARAMS
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| 25 | #define CATEGORY Analysis
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| [052bfd8] | 26 | #define MENUNAME "analysis"
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| 27 | #define MENUPOSITION 5
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| [9ee38b] | 28 | #define ACTIONNAME PrincipalAxisSystem
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| 29 | #define TOKEN "principal-axis-system"
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| [24fbf3] | 30 |
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| 31 | // finally the information stored in the ActionTrait specialization
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| 32 | #define DESCRIPTION "calculate the principal axis system of the specified molecule"
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| 33 | #undef SHORTFORM
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