author | cniehaus <cniehaus> | 2002-09-16 10:45:04 (UTC) |
---|---|---|
committer | cniehaus <cniehaus> | 2002-09-16 10:45:04 (UTC) |
commit | d5d64f7617836096a4e9de81997ada7b6f220b47 (patch) (unidiff) | |
tree | b0ad367ecd4327d8a95b22e725ec4e5b14efa230 /noncore | |
parent | 1286c243028874523eb2805a0d07ae478537a20c (diff) | |
download | opie-d5d64f7617836096a4e9de81997ada7b6f220b47.zip opie-d5d64f7617836096a4e9de81997ada7b6f220b47.tar.gz opie-d5d64f7617836096a4e9de81997ada7b6f220b47.tar.bz2 |
yes, there is still a lot missing and it won't work for anyone due to
a hardcoded path but at least in theorie (if you copy kmolweights to
the correct position) it will work now. more to come this evening or so.
-rw-r--r-- | noncore/apps/oxygen/calcdlg.ui | 203 | ||||
-rw-r--r-- | noncore/apps/oxygen/calcdlgui.cpp | 2 | ||||
-rw-r--r-- | noncore/apps/oxygen/kmolcalc.cpp | 40 | ||||
-rw-r--r-- | noncore/apps/oxygen/kmolcalc.h | 5 |
4 files changed, 99 insertions, 151 deletions
diff --git a/noncore/apps/oxygen/calcdlg.ui b/noncore/apps/oxygen/calcdlg.ui index e0b19f9..5b0c53e 100644 --- a/noncore/apps/oxygen/calcdlg.ui +++ b/noncore/apps/oxygen/calcdlg.ui | |||
@@ -2,51 +2,51 @@ | |||
2 | <class>CalcDlg</class> | 2 | <class>CalcDlg</class> |
3 | <widget> | 3 | <widget> |
4 | <class>QWidget</class> | 4 | <class>QWidget</class> |
5 | <property stdset="1"> | 5 | <property stdset="1"> |
6 | <name>name</name> | 6 | <name>name</name> |
7 | <cstring>CalcDlg</cstring> | 7 | <cstring>CalcDlg</cstring> |
8 | </property> | 8 | </property> |
9 | <property stdset="1"> | 9 | <property stdset="1"> |
10 | <name>geometry</name> | 10 | <name>geometry</name> |
11 | <rect> | 11 | <rect> |
12 | <x>0</x> | 12 | <x>0</x> |
13 | <y>0</y> | 13 | <y>0</y> |
14 | <width>218</width> | 14 | <width>275</width> |
15 | <height>274</height> | 15 | <height>357</height> |
16 | </rect> | 16 | </rect> |
17 | </property> | 17 | </property> |
18 | <property stdset="1"> | 18 | <property stdset="1"> |
19 | <name>caption</name> | 19 | <name>caption</name> |
20 | <string>Network Time</string> | 20 | <string>Network Time</string> |
21 | </property> | 21 | </property> |
22 | <property> | 22 | <property> |
23 | <name>layoutMargin</name> | 23 | <name>layoutMargin</name> |
24 | </property> | 24 | </property> |
25 | <property> | 25 | <property> |
26 | <name>layoutSpacing</name> | 26 | <name>layoutSpacing</name> |
27 | </property> | 27 | </property> |
28 | <widget> | 28 | <widget> |
29 | <class>QTabWidget</class> | 29 | <class>QTabWidget</class> |
30 | <property stdset="1"> | 30 | <property stdset="1"> |
31 | <name>name</name> | 31 | <name>name</name> |
32 | <cstring>TabWidgetMain</cstring> | 32 | <cstring>TabWidgetMain</cstring> |
33 | </property> | 33 | </property> |
34 | <property stdset="1"> | 34 | <property stdset="1"> |
35 | <name>geometry</name> | 35 | <name>geometry</name> |
36 | <rect> | 36 | <rect> |
37 | <x>10</x> | 37 | <x>0</x> |
38 | <y>0</y> | 38 | <y>0</y> |
39 | <width>200</width> | 39 | <width>270</width> |
40 | <height>260</height> | 40 | <height>350</height> |
41 | </rect> | 41 | </rect> |
42 | </property> | 42 | </property> |
43 | <property> | 43 | <property> |
44 | <name>layoutMargin</name> | 44 | <name>layoutMargin</name> |
45 | </property> | 45 | </property> |
46 | <property> | 46 | <property> |
47 | <name>layoutSpacing</name> | 47 | <name>layoutSpacing</name> |
48 | </property> | 48 | </property> |
49 | <widget> | 49 | <widget> |
50 | <class>QWidget</class> | 50 | <class>QWidget</class> |
51 | <property stdset="1"> | 51 | <property stdset="1"> |
52 | <name>name</name> | 52 | <name>name</name> |
@@ -56,173 +56,160 @@ | |||
56 | <name>title</name> | 56 | <name>title</name> |
57 | <string>Molweight</string> | 57 | <string>Molweight</string> |
58 | </attribute> | 58 | </attribute> |
59 | <widget> | 59 | <widget> |
60 | <class>QFrame</class> | 60 | <class>QFrame</class> |
61 | <property stdset="1"> | 61 | <property stdset="1"> |
62 | <name>name</name> | 62 | <name>name</name> |
63 | <cstring>FrameSystemTime</cstring> | 63 | <cstring>FrameSystemTime</cstring> |
64 | </property> | 64 | </property> |
65 | <property stdset="1"> | 65 | <property stdset="1"> |
66 | <name>geometry</name> | 66 | <name>geometry</name> |
67 | <rect> | 67 | <rect> |
68 | <x>2</x> | 68 | <x>0</x> |
69 | <y>2</y> | 69 | <y>0</y> |
70 | <width>180</width> | 70 | <width>260</width> |
71 | <height>220</height> | 71 | <height>320</height> |
72 | </rect> | 72 | </rect> |
73 | </property> | 73 | </property> |
74 | <property stdset="1"> | 74 | <property stdset="1"> |
75 | <name>frameShape</name> | 75 | <name>frameShape</name> |
76 | <enum>StyledPanel</enum> | 76 | <enum>StyledPanel</enum> |
77 | </property> | 77 | </property> |
78 | <property stdset="1"> | 78 | <property stdset="1"> |
79 | <name>frameShadow</name> | 79 | <name>frameShadow</name> |
80 | <enum>Raised</enum> | 80 | <enum>Raised</enum> |
81 | </property> | 81 | </property> |
82 | <widget> | 82 | <widget> |
83 | <class>QLabel</class> | ||
84 | <property stdset="1"> | ||
85 | <name>name</name> | ||
86 | <cstring>TextLabel1_4</cstring> | ||
87 | </property> | ||
88 | <property stdset="1"> | ||
89 | <name>geometry</name> | ||
90 | <rect> | ||
91 | <x>1</x> | ||
92 | <y>1</y> | ||
93 | <width>298</width> | ||
94 | <height>16</height> | ||
95 | </rect> | ||
96 | </property> | ||
97 | <property stdset="1"> | ||
98 | <name>text</name> | ||
99 | <string>Formula:</string> | ||
100 | </property> | ||
101 | </widget> | ||
102 | <widget> | ||
103 | <class>QLayoutWidget</class> | 83 | <class>QLayoutWidget</class> |
104 | <property stdset="1"> | 84 | <property stdset="1"> |
105 | <name>name</name> | 85 | <name>name</name> |
106 | <cstring>Layout7</cstring> | 86 | <cstring>Layout7</cstring> |
107 | </property> | 87 | </property> |
108 | <property stdset="1"> | 88 | <property stdset="1"> |
109 | <name>geometry</name> | 89 | <name>geometry</name> |
110 | <rect> | 90 | <rect> |
111 | <x>0</x> | 91 | <x>0</x> |
112 | <y>50</y> | 92 | <y>0</y> |
113 | <width>175</width> | 93 | <width>260</width> |
114 | <height>30</height> | 94 | <height>320</height> |
115 | </rect> | 95 | </rect> |
116 | </property> | 96 | </property> |
117 | <hbox> | 97 | <vbox> |
118 | <property stdset="1"> | 98 | <property stdset="1"> |
119 | <name>margin</name> | 99 | <name>margin</name> |
120 | <number>0</number> | 100 | <number>0</number> |
121 | </property> | 101 | </property> |
122 | <property stdset="1"> | 102 | <property stdset="1"> |
123 | <name>spacing</name> | 103 | <name>spacing</name> |
124 | <number>6</number> | 104 | <number>6</number> |
125 | </property> | 105 | </property> |
126 | <widget> | 106 | <widget> |
127 | <class>QPushButton</class> | 107 | <class>QLabel</class> |
128 | <property stdset="1"> | 108 | <property stdset="1"> |
129 | <name>name</name> | 109 | <name>name</name> |
130 | <cstring>calculate</cstring> | 110 | <cstring>TextLabel1_4</cstring> |
131 | </property> | 111 | </property> |
132 | <property stdset="1"> | 112 | <property stdset="1"> |
133 | <name>text</name> | 113 | <name>text</name> |
134 | <string>Calculate</string> | 114 | <string>Formula:</string> |
115 | </property> | ||
116 | </widget> | ||
117 | <widget> | ||
118 | <class>QLineEdit</class> | ||
119 | <property stdset="1"> | ||
120 | <name>name</name> | ||
121 | <cstring>formula</cstring> | ||
122 | </property> | ||
123 | </widget> | ||
124 | <widget> | ||
125 | <class>QLayoutWidget</class> | ||
126 | <property stdset="1"> | ||
127 | <name>name</name> | ||
128 | <cstring>Layout7</cstring> | ||
135 | </property> | 129 | </property> |
130 | <hbox> | ||
131 | <property stdset="1"> | ||
132 | <name>margin</name> | ||
133 | <number>0</number> | ||
134 | </property> | ||
135 | <property stdset="1"> | ||
136 | <name>spacing</name> | ||
137 | <number>6</number> | ||
138 | </property> | ||
139 | <widget> | ||
140 | <class>QPushButton</class> | ||
141 | <property stdset="1"> | ||
142 | <name>name</name> | ||
143 | <cstring>calculate</cstring> | ||
144 | </property> | ||
145 | <property stdset="1"> | ||
146 | <name>text</name> | ||
147 | <string>Calculate</string> | ||
148 | </property> | ||
149 | </widget> | ||
150 | <widget> | ||
151 | <class>QPushButton</class> | ||
152 | <property stdset="1"> | ||
153 | <name>name</name> | ||
154 | <cstring>clear_fields</cstring> | ||
155 | </property> | ||
156 | <property stdset="1"> | ||
157 | <name>text</name> | ||
158 | <string>Clear</string> | ||
159 | </property> | ||
160 | </widget> | ||
161 | </hbox> | ||
136 | </widget> | 162 | </widget> |
137 | <widget> | 163 | <widget> |
138 | <class>QPushButton</class> | 164 | <class>QLabel</class> |
139 | <property stdset="1"> | 165 | <property stdset="1"> |
140 | <name>name</name> | 166 | <name>name</name> |
141 | <cstring>clear_fields</cstring> | 167 | <cstring>TextLabel2_4</cstring> |
142 | </property> | 168 | </property> |
143 | <property stdset="1"> | 169 | <property stdset="1"> |
144 | <name>text</name> | 170 | <name>text</name> |
145 | <string>Clear</string> | 171 | <string>Result:</string> |
146 | </property> | 172 | </property> |
147 | </widget> | 173 | </widget> |
148 | </hbox> | 174 | <widget> |
149 | </widget> | 175 | <class>QLineEdit</class> |
150 | <widget> | 176 | <property stdset="1"> |
151 | <class>QLineEdit</class> | 177 | <name>name</name> |
152 | <property stdset="1"> | 178 | <cstring>result</cstring> |
153 | <name>name</name> | 179 | </property> |
154 | <cstring>formula</cstring> | 180 | </widget> |
155 | </property> | 181 | <widget> |
156 | <property stdset="1"> | 182 | <class>QLabel</class> |
157 | <name>geometry</name> | 183 | <property stdset="1"> |
158 | <rect> | 184 | <name>name</name> |
159 | <x>0</x> | 185 | <cstring>TextLabel1</cstring> |
160 | <y>20</y> | 186 | </property> |
161 | <width>170</width> | 187 | <property stdset="1"> |
162 | <height>22</height> | 188 | <name>text</name> |
163 | </rect> | 189 | <string>Elemental composition (%):</string> |
164 | </property> | 190 | </property> |
165 | </widget> | 191 | </widget> |
166 | <widget> | 192 | <widget> |
167 | <class>QMultiLineEdit</class> | 193 | <class>QMultiLineEdit</class> |
168 | <property stdset="1"> | 194 | <property stdset="1"> |
169 | <name>name</name> | 195 | <name>name</name> |
170 | <cstring>anal_display</cstring> | 196 | <cstring>anal_display</cstring> |
171 | </property> | 197 | </property> |
172 | <property stdset="1"> | 198 | <property stdset="1"> |
173 | <name>geometry</name> | 199 | <name>readOnly</name> |
174 | <rect> | 200 | <bool>true</bool> |
175 | <x>0</x> | 201 | </property> |
176 | <y>130</y> | 202 | </widget> |
177 | <width>170</width> | 203 | </vbox> |
178 | <height>80</height> | ||
179 | </rect> | ||
180 | </property> | ||
181 | </widget> | ||
182 | <widget> | ||
183 | <class>QLineEdit</class> | ||
184 | <property stdset="1"> | ||
185 | <name>name</name> | ||
186 | <cstring>result</cstring> | ||
187 | </property> | ||
188 | <property stdset="1"> | ||
189 | <name>geometry</name> | ||
190 | <rect> | ||
191 | <x>0</x> | ||
192 | <y>100</y> | ||
193 | <width>170</width> | ||
194 | <height>22</height> | ||
195 | </rect> | ||
196 | </property> | ||
197 | </widget> | ||
198 | <widget> | ||
199 | <class>QLabel</class> | ||
200 | <property stdset="1"> | ||
201 | <name>name</name> | ||
202 | <cstring>TextLabel2_4</cstring> | ||
203 | </property> | ||
204 | <property stdset="1"> | ||
205 | <name>geometry</name> | ||
206 | <rect> | ||
207 | <x>1</x> | ||
208 | <y>86</y> | ||
209 | <width>298</width> | ||
210 | <height>16</height> | ||
211 | </rect> | ||
212 | </property> | ||
213 | <property stdset="1"> | ||
214 | <name>text</name> | ||
215 | <string>Result:</string> | ||
216 | </property> | ||
217 | </widget> | 204 | </widget> |
218 | </widget> | 205 | </widget> |
219 | </widget> | 206 | </widget> |
220 | <widget> | 207 | <widget> |
221 | <class>QWidget</class> | 208 | <class>QWidget</class> |
222 | <property stdset="1"> | 209 | <property stdset="1"> |
223 | <name>name</name> | 210 | <name>name</name> |
224 | <cstring>tabNtp</cstring> | 211 | <cstring>tabNtp</cstring> |
225 | </property> | 212 | </property> |
226 | <attribute> | 213 | <attribute> |
227 | <name>title</name> | 214 | <name>title</name> |
228 | <string>Nernst</string> | 215 | <string>Nernst</string> |
diff --git a/noncore/apps/oxygen/calcdlgui.cpp b/noncore/apps/oxygen/calcdlgui.cpp index e9b40d3..e40e2c7 100644 --- a/noncore/apps/oxygen/calcdlgui.cpp +++ b/noncore/apps/oxygen/calcdlgui.cpp | |||
@@ -7,27 +7,29 @@ | |||
7 | * * | 7 | * * |
8 | **************************************************************************/ | 8 | **************************************************************************/ |
9 | #include "oxygen.h" | 9 | #include "oxygen.h" |
10 | 10 | ||
11 | #include "calcdlgui.h" | 11 | #include "calcdlgui.h" |
12 | #include "kmolcalc.h" | 12 | #include "kmolcalc.h" |
13 | #include <qlineedit.h> | 13 | #include <qlineedit.h> |
14 | #include <qmultilineedit.h> | 14 | #include <qmultilineedit.h> |
15 | #include <qpushbutton.h> | 15 | #include <qpushbutton.h> |
16 | 16 | ||
17 | calcDlgUI::calcDlgUI() : CalcDlg() | 17 | calcDlgUI::calcDlgUI() : CalcDlg() |
18 | { | 18 | { |
19 | this->showMaximized(); | ||
19 | kmolcalc = new KMolCalc; | 20 | kmolcalc = new KMolCalc; |
20 | connect( calculate, SIGNAL( clicked() ), this, SLOT( calc() ) ); | 21 | connect( calculate, SIGNAL( clicked() ), this, SLOT( calc() ) ); |
21 | connect( clear_fields, SIGNAL( clicked() ), this, SLOT( clear() ) ); | 22 | connect( clear_fields, SIGNAL( clicked() ), this, SLOT( clear() ) ); |
23 | result->setReadOnly( true ); | ||
22 | } | 24 | } |
23 | 25 | ||
24 | void calcDlgUI::calc() | 26 | void calcDlgUI::calc() |
25 | { | 27 | { |
26 | QString compound( formula->text() ); | 28 | QString compound( formula->text() ); |
27 | if ( compound.isEmpty() ) { | 29 | if ( compound.isEmpty() ) { |
28 | clear(); | 30 | clear(); |
29 | return; | 31 | return; |
30 | } | 32 | } |
31 | QString errors( kmolcalc->readFormula( compound ) ); | 33 | QString errors( kmolcalc->readFormula( compound ) ); |
32 | QString mw, ea; | 34 | QString mw, ea; |
33 | double weight = kmolcalc->getWeight(); | 35 | double weight = kmolcalc->getWeight(); |
diff --git a/noncore/apps/oxygen/kmolcalc.cpp b/noncore/apps/oxygen/kmolcalc.cpp index 7257c4a..0ba52da 100644 --- a/noncore/apps/oxygen/kmolcalc.cpp +++ b/noncore/apps/oxygen/kmolcalc.cpp | |||
@@ -1,16 +1,16 @@ | |||
1 | /* | 1 | /* |
2 | * kmolcalc.cpp | 2 | * kmolcalc.cpp |
3 | * | 3 | * |
4 | * Copyright (C) 2000 Tomislav Gountchev <tomi@idiom.com> | 4 | * Copyright (C) 2000,2001 Tomislav Gountchev <tomi@idiom.com> |
5 | * Copyright (C) 2002 Carsten Niehaus <cniehaus@handhelds.org> | 5 | * Copyright (C) 2002 Carsten Niehaus <cniehaus@handhelds.org> |
6 | */ | 6 | */ |
7 | 7 | ||
8 | /** | 8 | /** |
9 | * KMOLCALC is the calculation engine. It knows about a hashtable of user defined atomic | 9 | * KMOLCALC is the calculation engine. It knows about a hashtable of user defined atomic |
10 | * weights and group definitions ELSTABLE, and the currently processed formula, stored | 10 | * weights and group definitions ELSTABLE, and the currently processed formula, stored |
11 | * as a list of elements and their coefficients, ELEMENTS. | 11 | * as a list of elements and their coefficients, ELEMENTS. |
12 | */ | 12 | */ |
13 | 13 | ||
14 | #include "kmolcalc.h" | 14 | #include "kmolcalc.h" |
15 | #include <qdict.h> | 15 | #include <qdict.h> |
16 | #include <qdir.h> | 16 | #include <qdir.h> |
@@ -27,46 +27,27 @@ KMolCalc::KMolCalc() { | |||
27 | readElstable(); | 27 | readElstable(); |
28 | } | 28 | } |
29 | 29 | ||
30 | KMolCalc::~KMolCalc() { | 30 | KMolCalc::~KMolCalc() { |
31 | delete elements; | 31 | delete elements; |
32 | } | 32 | } |
33 | 33 | ||
34 | void KMolCalc::readElstable() { | 34 | void KMolCalc::readElstable() { |
35 | weight = -1; // not calculated yet | 35 | weight = -1; // not calculated yet |
36 | if (elstable) delete elstable; | 36 | if (elstable) delete elstable; |
37 | elstable = new QDict<SubUnit> (197, TRUE); | 37 | elstable = new QDict<SubUnit> (197, TRUE); |
38 | elstable->setAutoDelete(TRUE); | 38 | elstable->setAutoDelete(TRUE); |
39 | QStringList files = "/home/opie/opie/noncore/apps/oxigen/kmolweights"; | 39 | mwfile = "/home/opie/opie/noncore/apps/oxygen/kmolweights"; |
40 | mwfile = "/home/opie/opie/noncore/apps/oxigen/kmolweights"; | ||
41 | QFile f(mwfile); | 40 | QFile f(mwfile); |
42 | QString* latest_f = &mwfile; | ||
43 | for (uint i=0; i<files.count(); i++) { | ||
44 | if (QFileInfo(QFile(files[i])).lastModified() > QFileInfo(QFile(*latest_f)).lastModified()) { | ||
45 | latest_f = &files[i]; | ||
46 | } | ||
47 | } | ||
48 | QFile lf(*latest_f); | ||
49 | if (f.exists()) readMwfile(f); | 41 | if (f.exists()) readMwfile(f); |
50 | if (!f.exists()) { | ||
51 | readMwfile(lf); | ||
52 | writeElstable(); | ||
53 | } else if (QFileInfo(f).lastModified() < QFileInfo(lf).lastModified()) { | ||
54 | // announce | ||
55 | QMessageBox::information | ||
56 | (0, "Warning:", "Found new global Mw file.\nLocal definitions will be updated.", QMessageBox::Ok); | ||
57 | readMwfile(lf); | ||
58 | writeElstable(); | ||
59 | } | ||
60 | |||
61 | } | 42 | } |
62 | 43 | ||
63 | 44 | ||
64 | /** | 45 | /** |
65 | * Parse a string S and construct the ElementList this->ELEMENTS, representing the | 46 | * Parse a string S and construct the ElementList this->ELEMENTS, representing the |
66 | * composition of S. Returns 0 if successful, or an error code (currently -1) if | 47 | * composition of S. Returns 0 if successful, or an error code (currently -1) if |
67 | * parsing failed. | 48 | * parsing failed. |
68 | * The elements is S must be valid element or group symbols, as stored in this->ELSTABLE. | 49 | * The elements is S must be valid element or group symbols, as stored in this->ELSTABLE. |
69 | * See help files for correct formula syntax. | 50 | * See help files for correct formula syntax. |
70 | */ | 51 | */ |
71 | QString KMolCalc::readFormula(const QString& s) { | 52 | QString KMolCalc::readFormula(const QString& s) { |
72 | weight = -1; | 53 | weight = -1; |
@@ -179,41 +160,24 @@ void KMolCalc::readMwfile(QFile& f) { | |||
179 | if (! f.open(IO_ReadOnly)) return; //ERROR | 160 | if (! f.open(IO_ReadOnly)) return; //ERROR |
180 | QTextStream fs (&f); | 161 | QTextStream fs (&f); |
181 | QString line; | 162 | QString line; |
182 | while (! fs.eof()) { | 163 | while (! fs.eof()) { |
183 | line = fs.readLine(); | 164 | line = fs.readLine(); |
184 | SubUnit* s = SubUnit::makeSubUnit(line); | 165 | SubUnit* s = SubUnit::makeSubUnit(line); |
185 | elstable->replace(s->getName(), s); | 166 | elstable->replace(s->getName(), s); |
186 | } | 167 | } |
187 | f.close(); | 168 | f.close(); |
188 | } | 169 | } |
189 | 170 | ||
190 | /** | 171 | /** |
191 | * Save the element definitions file. | ||
192 | */ | ||
193 | void KMolCalc::writeElstable() { | ||
194 | QFile f(mwfile); | ||
195 | if (! f.open(IO_WriteOnly)) return; //ERROR | ||
196 | QTextStream fs (&f); | ||
197 | QString line; | ||
198 | QDictIterator<SubUnit> it(*elstable); | ||
199 | while (it.current()) { | ||
200 | it.current()->writeOut(line); | ||
201 | fs << line << endl; | ||
202 | ++it; | ||
203 | } | ||
204 | f.close(); | ||
205 | } | ||
206 | |||
207 | /** | ||
208 | * Remove a group or element definition from ELSTABLE. | 172 | * Remove a group or element definition from ELSTABLE. |
209 | */ | 173 | */ |
210 | void KMolCalc::undefineGroup (const QString& name) { | 174 | void KMolCalc::undefineGroup (const QString& name) { |
211 | elstable->remove (name); | 175 | elstable->remove (name); |
212 | } | 176 | } |
213 | 177 | ||
214 | /** | 178 | /** |
215 | * Add a new element name - atomic weight record to the ELSTABLE hashtable. Assumes | 179 | * Add a new element name - atomic weight record to the ELSTABLE hashtable. Assumes |
216 | * NAME has valid syntax. | 180 | * NAME has valid syntax. |
217 | 181 | ||
218 | */ | 182 | */ |
219 | void KMolCalc::defineElement (const QString& name, double weight) { | 183 | void KMolCalc::defineElement (const QString& name, double weight) { |
diff --git a/noncore/apps/oxygen/kmolcalc.h b/noncore/apps/oxygen/kmolcalc.h index c3e02f3..c589133 100644 --- a/noncore/apps/oxygen/kmolcalc.h +++ b/noncore/apps/oxygen/kmolcalc.h | |||
@@ -69,29 +69,24 @@ public: | |||
69 | /** | 69 | /** |
70 | * Add a new group definition to the ELSTABLE. Returns "OK" if OK, error message | 70 | * Add a new group definition to the ELSTABLE. Returns "OK" if OK, error message |
71 | * if parsing FORMULA fails. Assumes the syntax of NAME is correct. | 71 | * if parsing FORMULA fails. Assumes the syntax of NAME is correct. |
72 | */ | 72 | */ |
73 | QString defineGroup(const QString& name, const QString& formula); | 73 | QString defineGroup(const QString& name, const QString& formula); |
74 | 74 | ||
75 | /** | 75 | /** |
76 | * Remove a group or element definition from ELSTABLE. | 76 | * Remove a group or element definition from ELSTABLE. |
77 | */ | 77 | */ |
78 | void undefineGroup(const QString& name); | 78 | void undefineGroup(const QString& name); |
79 | 79 | ||
80 | /** | 80 | /** |
81 | * Save the element definitions file. | ||
82 | */ | ||
83 | void writeElstable(); | ||
84 | |||
85 | /** | ||
86 | * Read the element definitions file and construct ELSTABLE. | 81 | * Read the element definitions file and construct ELSTABLE. |
87 | */ | 82 | */ |
88 | void readElstable(); | 83 | void readElstable(); |
89 | 84 | ||
90 | /** | 85 | /** |
91 | * The element dictionary. | 86 | * The element dictionary. |
92 | */ | 87 | */ |
93 | QDict<SubUnit>* elstable; | 88 | QDict<SubUnit>* elstable; |
94 | 89 | ||
95 | QString mwfile; | 90 | QString mwfile; |
96 | 91 | ||
97 | private: | 92 | private: |