Split off the NMR related analyses from gmx energy.
[gromacs.git] / src / testutils / xvgtest.cpp
blobd1b2a3e6f0f189cf891753211bedd64c292ee0c3
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35 /*! \internal \file
36 * \brief
37 * Implements routine to check the content of xvg files.
39 * \author David van der Spoel <david.vanderspoel@icm.uu.se>
40 * \author Teemu Murtola <teemu.murtola@gmail.com>
41 * \ingroup module_testutils
43 #include "gmxpre.h"
45 #include "xvgtest.h"
47 #include <cerrno>
48 #include <cstdlib>
50 #include <vector>
52 #include "gromacs/utility/gmxassert.h"
53 #include "gromacs/utility/stringutil.h"
54 #include "gromacs/utility/textstream.h"
56 #include "testutils/refdata.h"
57 #include "testutils/testasserts.h"
58 #include "testutils/textblockmatchers.h"
60 namespace gmx
62 namespace test
65 namespace
68 class XvgMatcher : public ITextBlockMatcher
70 public:
71 explicit XvgMatcher(const XvgMatchSettings &settings)
72 : settings_(settings)
76 virtual void checkStream(TextInputStream *stream,
77 TestReferenceChecker *checker)
79 checkXvgFile(stream, checker, settings_);
82 private:
83 XvgMatchSettings settings_;
86 //! Helper function to identify which @ lines in xvg files should be tested.
87 bool isRelevantXvgCommand(const std::string &line)
89 return contains(line, " title ")
90 || contains(line, " subtitle ")
91 || contains(line, " label ")
92 || contains(line, "@TYPE ")
93 || contains(line, " legend \"");
96 //! Helper function to check a single xvg value in a sequence.
97 void checkXvgDataPoint(TestReferenceChecker *checker, const std::string &value)
99 checker->checkRealFromString(value, nullptr);
102 } // namespace
104 void checkXvgFile(TextInputStream *input,
105 TestReferenceChecker *checker,
106 const XvgMatchSettings &settings)
108 TestReferenceChecker legendChecker(checker->checkCompound("XvgLegend", "Legend"));
109 TestReferenceChecker dataChecker(checker->checkCompound("XvgData", "Data"));
110 dataChecker.setDefaultTolerance(settings.tolerance);
112 std::string legendText;
113 int dataRowCount = 0;
114 std::string line;
115 while (input->readLine(&line))
117 // Ignore comments, as they contain dynamic content, and very little of
118 // that would be useful to test (and in particular, not with every
119 // output file).
120 if (startsWith(line, "#"))
122 continue;
124 if (startsWith(line, "@"))
126 if (isRelevantXvgCommand(line))
128 legendText.append(stripString(line.substr(1)));
129 legendText.append("\n");
131 continue;
133 if (!settings.testData)
135 break;
137 const std::vector<std::string> columns = splitString(line);
138 const std::string id = formatString("Row%d", dataRowCount);
139 dataChecker.checkSequence(columns.begin(), columns.end(), id.c_str(),
140 &checkXvgDataPoint);
141 ++dataRowCount;
143 dataChecker.checkUnusedEntries();
144 legendChecker.checkTextBlock(legendText, "XvgLegend");
147 TextBlockMatcherPointer XvgMatch::createMatcher() const
149 return TextBlockMatcherPointer(new XvgMatcher(settings_));
152 } // namespace test
153 } // namespace gmx