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<div id="projectname">The Gnome Chemistry Utils
 <span id="projectnumber">0.14.8</span>
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<li class="navelem"><a class="el" href="namespacegcu.html">gcu</a></li><li class="navelem"><a class="el" href="classgcu_1_1FormulaResidue.html">FormulaResidue</a></li> </ul>
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<a href="#pub-methods">Public Member Functions</a> |
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<div class="title">gcu::FormulaResidue Class Reference</div> </div>
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<p><a class="el" href="classgcu_1_1Residue.html">Residue</a>.
<a href="classgcu_1_1FormulaResidue.html#details">More...</a></p>
<p><code>#include <<a class="el" href="formula_8h_source.html">formula.h</a>></code></p>
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Inheritance diagram for gcu::FormulaResidue:</div>
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<img src="classgcu_1_1FormulaResidue.png" usemap="#gcu::FormulaResidue_map" alt=""/>
<map id="gcu::FormulaResidue_map" name="gcu::FormulaResidue_map">
<area href="classgcu_1_1FormulaElt.html" alt="gcu::FormulaElt" shape="rect" coords="0,0,130,24"/>
</map>
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<table class="memberdecls">
<tr class="heading"><td colspan="2"><h2 class="groupheader"><a name="pub-methods"></a>
Public Member Functions</h2></td></tr>
<tr class="memitem:ac97865ff1970377a9eff9ad5a9fb1872"><td class="memItemLeft" align="right" valign="top"> </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#ac97865ff1970377a9eff9ad5a9fb1872">FormulaResidue</a> (<a class="el" href="classgcu_1_1Residue.html">Residue</a> const *res, char const *symbol, int Z)</td></tr>
<tr class="separator:ac97865ff1970377a9eff9ad5a9fb1872"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:ac8c7a2880a27a74bab5abbffc011284a"><td class="memItemLeft" align="right" valign="top">virtual </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#ac8c7a2880a27a74bab5abbffc011284a">~FormulaResidue</a> ()</td></tr>
<tr class="separator:ac8c7a2880a27a74bab5abbffc011284a"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:aea9d0af58133907701496bdf8a39f216"><td class="memItemLeft" align="right" valign="top">std::string </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#aea9d0af58133907701496bdf8a39f216">Markup</a> ()</td></tr>
<tr class="separator:aea9d0af58133907701496bdf8a39f216"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:aad3fca53d48084689db755595dcf2244"><td class="memItemLeft" align="right" valign="top">std::string </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#aad3fca53d48084689db755595dcf2244">Text</a> ()</td></tr>
<tr class="separator:aad3fca53d48084689db755595dcf2244"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:a6f58c8a43bde3d4c9f9fa47caa462795"><td class="memItemLeft" align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#a6f58c8a43bde3d4c9f9fa47caa462795">BuildRawFormula</a> (std::map< int, int > &raw)</td></tr>
<tr class="separator:a6f58c8a43bde3d4c9f9fa47caa462795"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:ac0f8028a11ddabeabf57c990edda4fd8"><td class="memItemLeft" align="right" valign="top">int </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#ac0f8028a11ddabeabf57c990edda4fd8">GetValence</a> ()</td></tr>
<tr class="separator:ac0f8028a11ddabeabf57c990edda4fd8"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:a868a29cbb195af080a57e8bacd321c6a"><td class="memItemLeft" align="right" valign="top">int </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#a868a29cbb195af080a57e8bacd321c6a">GetZ</a> (void) const </td></tr>
<tr class="separator:a868a29cbb195af080a57e8bacd321c6a"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="inherit_header pub_methods_classgcu_1_1FormulaElt"><td colspan="2" onclick="javascript:toggleInherit('pub_methods_classgcu_1_1FormulaElt')"><img src="closed.png" alt="-"/> Public Member Functions inherited from <a class="el" href="classgcu_1_1FormulaElt.html">gcu::FormulaElt</a></td></tr>
<tr class="memitem:af1eab0c0e8e950ce5c3a3211fb171fc2 inherit pub_methods_classgcu_1_1FormulaElt"><td class="memItemLeft" align="right" valign="top"> </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaElt.html#af1eab0c0e8e950ce5c3a3211fb171fc2">FormulaElt</a> ()</td></tr>
<tr class="separator:af1eab0c0e8e950ce5c3a3211fb171fc2 inherit pub_methods_classgcu_1_1FormulaElt"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:acadada2049798143f988afe7cabbe2a7 inherit pub_methods_classgcu_1_1FormulaElt"><td class="memItemLeft" align="right" valign="top">virtual </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaElt.html#acadada2049798143f988afe7cabbe2a7">~FormulaElt</a> ()</td></tr>
<tr class="separator:acadada2049798143f988afe7cabbe2a7 inherit pub_methods_classgcu_1_1FormulaElt"><td class="memSeparator" colspan="2"> </td></tr>
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<tr class="heading"><td colspan="2"><h2 class="groupheader"><a name="pub-attribs"></a>
Public Attributes</h2></td></tr>
<tr class="memitem:a369b1201247ea8fd82c6d6aa58ac8990"><td class="memItemLeft" align="right" valign="top"><a class="el" href="classgcu_1_1Residue.html">Residue</a> const * </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#a369b1201247ea8fd82c6d6aa58ac8990">residue</a></td></tr>
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<tr class="memitem:aadc733b09d3163992efbebb3a3b21b25"><td class="memItemLeft" align="right" valign="top">std::string </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaResidue.html#aadc733b09d3163992efbebb3a3b21b25">Symbol</a></td></tr>
<tr class="separator:aadc733b09d3163992efbebb3a3b21b25"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="inherit_header pub_attribs_classgcu_1_1FormulaElt"><td colspan="2" onclick="javascript:toggleInherit('pub_attribs_classgcu_1_1FormulaElt')"><img src="closed.png" alt="-"/> Public Attributes inherited from <a class="el" href="classgcu_1_1FormulaElt.html">gcu::FormulaElt</a></td></tr>
<tr class="memitem:a7f55ccd3dee7068ab604ecba0d9c4a4b inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memItemLeft" align="right" valign="top">int </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaElt.html#a7f55ccd3dee7068ab604ecba0d9c4a4b">stoich</a></td></tr>
<tr class="separator:a7f55ccd3dee7068ab604ecba0d9c4a4b inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:a2bba7b1588a7a029af6cdc31b2b25c65 inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memItemLeft" align="right" valign="top">unsigned </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaElt.html#a2bba7b1588a7a029af6cdc31b2b25c65">start</a></td></tr>
<tr class="separator:a2bba7b1588a7a029af6cdc31b2b25c65 inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memSeparator" colspan="2"> </td></tr>
<tr class="memitem:a32d28fde9104f82a6495e87403691b8a inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memItemLeft" align="right" valign="top">unsigned </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1FormulaElt.html#a32d28fde9104f82a6495e87403691b8a">end</a></td></tr>
<tr class="separator:a32d28fde9104f82a6495e87403691b8a inherit pub_attribs_classgcu_1_1FormulaElt"><td class="memSeparator" colspan="2"> </td></tr>
</table>
<a name="details" id="details"></a><h2 class="groupheader">Detailed Description</h2>
<div class="textblock"><p><a class="el" href="classgcu_1_1Residue.html">Residue</a>. </p>
<p>class <a class="el" href="classgcu_1_1FormulaResidue.html" title="Residue. ">FormulaResidue</a> <a class="el" href="formula_8h.html">gcu/formula.h</a> Represents a residue in a formula. </p>
<p>Definition at line <a class="el" href="formula_8h_source.html#l00236">236</a> of file <a class="el" href="formula_8h_source.html">formula.h</a>.</p>
</div><h2 class="groupheader">Constructor & Destructor Documentation</h2>
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<td class="memname">gcu::FormulaResidue::FormulaResidue </td>
<td>(</td>
<td class="paramtype"><a class="el" href="classgcu_1_1Residue.html">Residue</a> const * </td>
<td class="paramname"><em>res</em>, </td>
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<td class="paramtype">char const * </td>
<td class="paramname"><em>symbol</em>, </td>
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<td class="paramtype">int </td>
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<dl class="params"><dt>Parameters</dt><dd>
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<tr><td class="paramname">res</td><td>a <a class="el" href="classgcu_1_1Residue.html">gcu::Residue</a>. </td></tr>
<tr><td class="paramname">symbol</td><td>the atoms group symbol </td></tr>
<tr><td class="paramname">Z</td><td>the atomic number of the element with the same symbol or 0. </td></tr>
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<td class="memname">virtual gcu::FormulaResidue::~FormulaResidue </td>
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<p>The destructor. </p>
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<h2 class="groupheader">Member Function Documentation</h2>
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<td class="memname">void gcu::FormulaResidue::BuildRawFormula </td>
<td>(</td>
<td class="paramtype">std::map< int, int > & </td>
<td class="paramname"><em>raw</em></td><td>)</td>
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<dl class="params"><dt>Parameters</dt><dd>
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<tr><td class="paramname">raw</td><td>where to put the result</td></tr>
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</dd>
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<p>Adds the number of atoms of each element to the map taking the stoichiometry coefficient into account. </p>
<p>Implements <a class="el" href="classgcu_1_1FormulaElt.html#a08a50700b8e01a8e8dc7e7de0d57b455">gcu::FormulaElt</a>.</p>
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<td class="memname">int gcu::FormulaResidue::GetValence </td>
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<dl class="section return"><dt>Returns</dt><dd>the (most probable) valence of the element. </dd></dl>
<p>Implements <a class="el" href="classgcu_1_1FormulaElt.html#a912a90e4b8ffb4771247361a00abf537">gcu::FormulaElt</a>.</p>
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<td class="memname">gcu::FormulaResidue::GetZ </td>
<td>(</td>
<td class="paramtype">void </td>
<td class="paramname"></td><td>)</td>
<td> const</td>
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<dl class="section return"><dt>Returns</dt><dd>the atomic number of the element with the same symbol or 0. </dd></dl>
<p>Definition at line <a class="el" href="formula_8h_source.html#l00279">279</a> of file <a class="el" href="formula_8h_source.html">formula.h</a>.</p>
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<td class="memname">std::string gcu::FormulaResidue::Markup </td>
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<dl class="section return"><dt>Returns</dt><dd>the string representation of the element as a markup. </dd></dl>
<p>Reimplemented from <a class="el" href="classgcu_1_1FormulaElt.html#a76cc52d2a13c7c6d793f84fe4128f07a">gcu::FormulaElt</a>.</p>
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<td class="memname">std::string gcu::FormulaResidue::Text </td>
<td>(</td>
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<dl class="section return"><dt>Returns</dt><dd>the string representation of the element as raw text. </dd></dl>
<p>Reimplemented from <a class="el" href="classgcu_1_1FormulaElt.html#a8e42ff57439e027ce915d154ce25426f">gcu::FormulaElt</a>.</p>
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<h2 class="groupheader">Member Data Documentation</h2>
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<td class="memname"><a class="el" href="classgcu_1_1Residue.html">Residue</a> const* gcu::FormulaResidue::residue</td>
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<p>The <a class="el" href="classgcu_1_1Residue.html">gcu::Residue</a> correponding to the found symbol. </p>
<p>Definition at line <a class="el" href="formula_8h_source.html#l00271">271</a> of file <a class="el" href="formula_8h_source.html">formula.h</a>.</p>
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<p>The symbol of the atoms group. </p>
<p>Definition at line <a class="el" href="formula_8h_source.html#l00275">275</a> of file <a class="el" href="formula_8h_source.html">formula.h</a>.</p>
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<hr/>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="formula_8h_source.html">formula.h</a></li>
</ul>
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