Last change
on this file since 48cd93 was e1a46d, checked in by Frederik Heber <heber@…>, 16 years ago |
All of my python script put into ESPACK and adapted with @PYTHON@ and so on.
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-
Property mode
set to
100644
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File size:
2.0 KB
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[a0bcf1] | 1 | using namespace std;
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| 2 | #include <iostream>
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| 3 | #include <iomanip>
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| 4 | #include <fstream>
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| 5 | #include <sstream>
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| 6 | #include <math.h>
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| 7 | #include <string>
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| 8 |
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| 9 |
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| 10 | int main(int argc, char **argv) {
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| 11 |
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| 12 | double avg, dev;
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| 13 | double tmp;
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| 14 | int i, j, col, zaehler;
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| 15 | int ecut;
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| 16 | int flag;
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| 17 | string zeile;
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[0fe2ca] | 18 | stringstream line;
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[a0bcf1] | 19 |
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| 20 | if (argc < 4) {
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| 21 | cout << "Usage: " << argv[0] << " <Spalte> <X> <File1> <File2> ...\n";
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| 22 | return(1);
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| 23 | }
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[0fe2ca] | 24 | line.str(argv[1]);
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| 25 | line >> col;
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| 26 | line.clear();
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| 27 | line.str(argv[2]);
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| 28 | line >> ecut;
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| 29 | cout << "Using " << col << " with Ecut of " << ecut << "." << endl;
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[a0bcf1] | 30 |
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| 31 | // get average
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| 32 | avg = 0.;
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| 33 | zaehler=0;
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| 34 | for (i=3;i<argc;i++) {
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| 35 | //cout << "Reading column " << col << " from file " << argv[i] << "\n";
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| 36 | ifstream test(argv[i]);
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| 37 | if (test == NULL) { cout << "Can't open File " << argv[i] << "\n"; return(255); }
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| 38 | flag=1;
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| 39 | //cout << "Looking for " << ecut << " \n";
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| 40 | while (getline(test, zeile, '\n')) {
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| 41 | //cout << zeile;
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| 42 | istringstream input(zeile);
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| 43 | input >> ws >> tmp;
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| 44 | if (tmp==(double)ecut) { // found correct line!
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| 45 | for (j=col;j>0;j--)
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| 46 | if (!input.eof())
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| 47 | input >> ws >> tmp;
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| 48 | else
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| 49 | flag=0;
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| 50 | //cout << tmp << "\n";
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| 51 | avg += tmp;
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| 52 | }
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| 53 | //else cout << " skipping\n";
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| 54 | }
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| 55 | zaehler+=flag;
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| 56 | test.close();
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| 57 | }
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| 58 | if (zaehler != 0) avg /= zaehler;
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| 59 |
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| 60 | // get deviation
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| 61 | dev = 0.;
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| 62 | zaehler=0;
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| 63 | for (i=3;i<argc;i++) {
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| 64 | //cout << "Reading column " << col << " from file " << argv[i] << "\n";
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| 65 | ifstream test(argv[i]);
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| 66 | if (test == NULL) { cout << "Can't open File " << argv[i] << "\n"; return(255); }
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| 67 | flag=1;
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| 68 | while (getline(test, zeile, '\n')) {
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| 69 | istringstream input(zeile);
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| 70 | input >> ws >> tmp;
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| 71 | if (tmp==(double)ecut) { // found correct line!
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| 72 | for (j=col;j>0;j--)
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| 73 | if (!input.eof())
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| 74 | input >> ws >> tmp;
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| 75 | else
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| 76 | flag=0;
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| 77 | //cout << tmp << "\n";
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| 78 | dev += pow(tmp - avg, 2);
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| 79 | }
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| 80 | }
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| 81 | zaehler+=flag;
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| 82 | test.close();
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| 83 | }
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| 84 | //dev = 1/(zaehler)*dev;
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| 85 | dev /= zaehler;
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| 86 |
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| 87 | cout << setprecision(8) << avg << "\t" << setprecision(8) << sqrt(dev) << "\n";
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| 88 | return(0);
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| 89 | }
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