AutomationFragmentation_failures
Candidate_v1.6.1
ChemicalSpaceEvaluator
Exclude_Hydrogens_annealWithBondGraph
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_contraction-expansion
Gui_displays_atomic_force_velocity
PythonUI_with_named_parameters
StoppableMakroAction
TremoloParser_IncreasedPrecision
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Last change
on this file since 6458e7 was 3d9a8d, checked in by Frederik Heber <heber@…>, 12 years ago |
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SamplingGrid has no more size parameter but an end array.
- this rather fits into scheme with the later to come window.
- also several changes in interface due to SamplingGrid::size -> ::end[3]
replacement.
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Property mode
set to
100644
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File size:
612 bytes
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| [1b01e9] | 1 | /*
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| 2 | * MPQCJob_binding.hpp
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| 3 | *
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| 4 | * Created on: Feb 11, 2013
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef MPQCJOB_BINDING_HPP_
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| 9 | #define MPQCJOB_BINDING_HPP_
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| 10 |
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| 11 | // include config.h
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| 12 | #ifdef HAVE_CONFIG_H
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| 13 | #include <config.h>
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| 14 | #endif
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| 15 |
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| 16 | // force binding to libMolecuilderJobs
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| 17 | #include "Jobs/MPQCJob.hpp"
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| 18 |
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| 19 | namespace __detail {
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| 20 | /** This is a dummy function to enforce binding of the executable to the
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| 21 | * jobs library.
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| 22 | */
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| 23 | void instantiateDummyMPQCJob()
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| 24 | {
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| 25 | const double begin[3] = { 0., 0., 0. };
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| [3d9a8d] | 26 | const double end[3] = { 1., 1., 1. };
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| 27 | MPQCJob job(1, "test.in", begin, end, 2);
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| [1b01e9] | 28 | }
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| 29 | }
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| 30 |
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| 31 | #endif /* MPQCJOB_BINDING_HPP_ */
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