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Viewing changes to src/statistics.cpp

Committer: Package Import Robot
Author(s): Daniel Leidert
Date: 2014-01-18 20:07:16 UTC
mfrom: (1.1.8)
Revision ID: package-import@ubuntu.com-20140118200716-whsmcg7fa1eyqecq

Tags: 140117-1

New upstream release.

files added:
src/plproj.cpp

src/plproj.h

files modified:
Makefile

README

debian/changelog

src/2df.cpp

src/2df.h

src/3df.cpp

src/3df.h

src/acf.cpp

src/acf.h

src/aggregate.h

src/analysis.h

src/analysisgroup.cpp

src/analysisgroup.h

src/asciiart.cpp

src/asciiart.h

src/atomgroup.cpp

src/atomgroup.h

src/backtrace.cpp

src/backtrace.h

src/base64.cpp

src/base64.h

src/bintools.cpp

src/bintools.h

src/bintree.cpp

src/bintree.h

src/cluster.cpp

src/cluster.h

src/config.h

src/dacf.cpp

src/dacf.h

src/database.cpp

src/database.h

src/df.cpp

src/df.h

src/element.h

src/elementdata.cpp

src/fesa.cpp

src/fesa.h

src/ffgen.cpp

src/ffgen.h

src/ffparm.cpp

src/fft.cpp

src/fft.h

src/gather.cpp

src/globalvar.cpp

src/globalvar.h

src/grace.cpp

src/grace.h

src/interface.cpp

src/interface.h

src/internalcoord.cpp

src/internalcoord.h

src/kiss_fft.cpp

src/kiss_fft.h

src/kiss_fft_guts.h

src/lmmin.cpp

src/lmmin.h

src/lmwrapper.cpp

src/lmwrapper.h

src/ltspec.cpp

src/ltspec.h

src/maintools.cpp

src/maintools.h

src/microhet.cpp

src/microhet.h

src/moltools.cpp

src/moltools.h

src/nbexchange.cpp

src/nbexchange.h

src/nbsearch.cpp

src/nbsearch.h

src/normalmode.cpp

src/normalmode.h

src/pdf.cpp

src/pdf.h

src/raman.cpp

src/raman.h

src/random.cpp

src/random.h

src/react.cpp

src/react.h

src/region.cpp

src/region.h

src/reordyn.cpp

src/reordyn.h

src/resp.cpp

src/resp.h

src/revsdf.cpp

src/revsdf.h

src/sdengine.cpp

src/sdengine.h

src/spectrum.cpp

src/spectrum.h

src/statistics.cpp

src/statistics.h

src/structurefactor.cpp

src/structurefactor.h

src/thermo.cpp

src/thermo.h

src/timestep.cpp

src/timestep.h

src/tools.cpp

src/tools.h

src/travis.cpp

src/travis.h

src/v_base_wl.cpp

src/v_c_loops.h

src/v_cell.cpp

src/v_cell.h

src/v_common.h

src/v_compute.cpp

src/v_compute.h

src/v_config.h

src/v_container.cpp

src/v_container.h

src/v_container_prd.cpp

src/v_container_prd.h

src/v_pre_container.cpp

src/voroanalysis.cpp

src/voroanalysis.h

src/vorowrapper.cpp

src/vorowrapper.h

src/xbytearray.cpp

src/xbytearray.h

src/xdf.cpp

src/xdf.h

src/xdmatrix3.cpp

src/xdmatrix3.h

src/xdoublearray.cpp

src/xdoublearray.h

src/xdvec3array.cpp

src/xdvec3array.h

src/xdvector3.cpp

src/xdvector3.h

src/xfloatarray.cpp

src/xfloatarray.h

src/xintarray.cpp

src/xintarray.h

src/xlongarray.cpp

src/xlongarray.h

src/xmatrix3.cpp

src/xmatrix3.h

src/xobarray.cpp

src/xobarray.h

src/xobject.h

src/xptrarray.cpp

src/xptrarray.h

src/xquaternion.h

src/xstring.cpp

src/xstring.h

src/xvec3array.cpp

src/xvec3array.h

src/xvector3.cpp

src/xvector3.h

src/xwordarray.cpp

src/xwordarray.h

src/ziggurat.cpp

src/ziggurat.h

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src/statistics.cpp

/*****************************************************************************

TRAVIS - Trajectory Analyzer and Visualizer

http://www.travis-analyzer.de/

2012-2013 Martin Thomas

This file written by Martin Brehm.

This program is free software: you can redistribute it and/or modify

it under the terms of the GNU General Public License as published by

the Free Software Foundation, either version 3 of the License, or

(at your option) any later version.

This program is distributed in the hope that it will be useful,

but WITHOUT ANY WARRANTY; without even the implied warranty of

MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the

GNU General Public License for more details.

You should have received a copy of the GNU General Public License

along with this program. If not, see <http://www.gnu.org/licenses/>.

*****************************************************************************/

#include "statistics.h"

CStatistics::CStatistics()

{

m_iSizeX = 0;

m_iSizeY = 0;

m_pMin = NULL;

m_pMax = NULL;

m_pAvg = NULL;

m_pCount = NULL;

m_waXValues.SetName("CStatistics::m_waXValues");

m_waYValues.SetName("CStatistics::m_waYValues");

}

CStatistics::~CStatistics()

{

if (m_pMin != NULL)

{

delete[] m_pMin;

m_pMin = NULL;

}

if (m_pMax != NULL)

{

delete[] m_pMax;

m_pMax = NULL;

}

if (m_pAvg != NULL)

{

delete[] m_pAvg;

m_pAvg = NULL;

}

if (m_pCount != NULL)

{

delete[] m_pCount;

m_pCount = NULL;

}

void CStatistics::Init(int x, int y)

{

int z;

m_iSizeX = x;

m_iSizeY = y;

try { m_pMin = new double[x*y]; } catch(...) { m_pMin = NULL; }

if (m_pMin == NULL) NewException((double)x*y*sizeof(double),__FILE__,__LINE__,__PRETTY_FUNCTION__);

try { m_pMax = new double[x*y]; } catch(...) { m_pMax = NULL; }

if (m_pMax == NULL) NewException((double)x*y*sizeof(double),__FILE__,__LINE__,__PRETTY_FUNCTION__);

try { m_pAvg = new double[x*y]; } catch(...) { m_pAvg = NULL; }

if (m_pAvg == NULL) NewException((double)x*y*sizeof(double),__FILE__,__LINE__,__PRETTY_FUNCTION__);

try { m_pCount = new double[x*y]; } catch(...) { m_pCount = NULL; }

if (m_pCount == NULL) NewException((double)x*y*sizeof(double),__FILE__,__LINE__,__PRETTY_FUNCTION__);

for (z=0;z<x*y;z++)

{

m_pMin[z] = 9999999999.0;

m_pMax[z] = 0.0;

m_pAvg[z] = 0.0;

m_pCount[z] = 0.0;

}

void CStatistics::Evaluate()

{

int z;

for (z=0;z<m_iSizeX*m_iSizeY;z++)

if (m_pCount[z] != 0)

100

m_pAvg[z] /= m_pCount[z];

101

}

102

103

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void CStatistics::Write(const char *pre, const char *s, const char *post)

105

{

106

BTIN;

107

FILE *a;

108

int x, y;

109

char buf[256];

110

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buf[0] = 0;

112

strcpy(buf,pre);

113

strcat(buf,s);

114

strcat(buf,post);

115

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a = OpenFileWrite(buf,true);

117

for (x=0;x<m_iSizeX;x++)

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for (y=0;y<m_iSizeY;y++)

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{

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fprintf(a,"%8d; %8d; ",m_waXValues[x]+1,m_waYValues[y]+1);

121

if (m_pCount[y*m_iSizeX+x] == 0)

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fprintf(a," - ; - ; - \n");

123

else fprintf(a,"%10.3f; %10.3f; %10.3f\n",m_pMin[y*m_iSizeX+x],m_pMax[y*m_iSizeX+x],m_pAvg[y*m_iSizeX+x]);

124

}

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fclose(a);

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BTOUT;

127

}

128

/*****************************************************************************

TRAVIS - Trajectory Analyzer and Visualizer

http://www.travis-analyzer.de/

2012-2014 Martin Thomas