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<title>The Gnome Chemistry Utils: gcu::Chem3dDoc Class Reference</title>
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<div class="navpath"><a class="el" href="namespacegcu.html">gcu</a>::<a class="el" href="classgcu_1_1Chem3dDoc.html">Chem3dDoc</a>
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<h1>gcu::Chem3dDoc Class Reference</h1><!-- doxytag: class="gcu::Chem3dDoc" --><!-- doxytag: inherits="gcu::GLDocument" -->
<p><code>#include <<a class="el" href="chem3ddoc_8h_source.html">gcu/chem3ddoc.h</a>></code></p>
<div class="dynheader">
Inheritance diagram for gcu::Chem3dDoc:</div>
<div class="dynsection">
<div class="center">
<img src="classgcu_1_1Chem3dDoc.gif" usemap="#gcu::Chem3dDoc_map" alt=""/>
<map id="gcu::Chem3dDoc_map" name="gcu::Chem3dDoc_map">
<area href="classgcu_1_1GLDocument.html" alt="gcu::GLDocument" shape="rect" coords="61,112,174,136"/>
<area href="classgcu_1_1Document.html" alt="gcu::Document" shape="rect" coords="61,56,174,80"/>
<area href="classgcu_1_1Object.html" alt="gcu::Object" shape="rect" coords="0,0,113,24"/>
<area href="classgcu_1_1DialogOwner.html" alt="gcu::DialogOwner" shape="rect" coords="123,0,236,24"/>
</map>
</div>
</div>
<p><a href="classgcu_1_1Chem3dDoc-members.html">List of all members.</a></p>
<table border="0" cellpadding="0" cellspacing="0">
<tr><td colspan="2"><h2>Public Member Functions</h2></td></tr>
<tr><td class="memItemLeft" align="right" valign="top"> </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#aed122da98350aa78a79e942f0afe494f">Chem3dDoc</a> ()</td></tr>
<tr><td class="memItemLeft" align="right" valign="top"> </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#ab84a63bcff9988e3617e7b01794f5dc3">Chem3dDoc</a> (<a class="el" href="classgcu_1_1Application.html">Application</a> *App, <a class="el" href="classgcu_1_1GLView.html">GLView</a> *View)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">virtual </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#a18d808656b023683ab3fb24a51c7f993">~Chem3dDoc</a> ()</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#af05ba220e27dd4d471783f802ca30134">Draw</a> (<a class="el" href="classgcu_1_1Matrix.html">Matrix</a> const &m) const </td></tr>
<tr><td class="memItemLeft" align="right" valign="top">bool </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#aa80f903c7660afa78e48c1929e04b486">IsEmpty</a> ()</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#a732761f38f0f5bcf32469533f9cbe038">Load</a> (char const *uri, char const *mime_type)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#ad32dd5ccfc336b4d7f5eb70e40135a5e">LoadData</a> (char const *data, char const *mime_type)</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">const char * </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#a113332852c6d5a17993ef623e9852b51">GetTitle</a> ()</td></tr>
<tr><td class="memItemLeft" align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classgcu_1_1Chem3dDoc.html#a3115aa51c6004c187a0ef627c6d16248">OnExportVRML</a> (std::string const &filename)</td></tr>
</table>
<hr/><a name="_details"></a><h2>Detailed Description</h2>
<p><a class="el" href="classgcu_1_1Document.html">Document</a> class for a molecule. Embeds an OpenBabel::OBMol object. </p>
<p>Definition at line <a class="el" href="chem3ddoc_8h_source.html#l00061">61</a> of file <a class="el" href="chem3ddoc_8h_source.html">chem3ddoc.h</a>.</p>
<hr/><h2>Constructor & Destructor Documentation</h2>
<a class="anchor" id="aed122da98350aa78a79e942f0afe494f"></a><!-- doxytag: member="gcu::Chem3dDoc::Chem3dDoc" ref="aed122da98350aa78a79e942f0afe494f" args="()" -->
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<td class="memname">gcu::Chem3dDoc::Chem3dDoc </td>
<td>(</td>
<td class="paramname"></td>
<td> ) </td>
<td></td>
</tr>
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<p>Default constructor </p>
</div>
</div>
<a class="anchor" id="ab84a63bcff9988e3617e7b01794f5dc3"></a><!-- doxytag: member="gcu::Chem3dDoc::Chem3dDoc" ref="ab84a63bcff9988e3617e7b01794f5dc3" args="(Application *App, GLView *View)" -->
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<td class="memname">gcu::Chem3dDoc::Chem3dDoc </td>
<td>(</td>
<td class="paramtype"><a class="el" href="classgcu_1_1Application.html">Application</a> * </td>
<td class="paramname"> <em>App</em>, </td>
</tr>
<tr>
<td class="paramkey"></td>
<td></td>
<td class="paramtype"><a class="el" href="classgcu_1_1GLView.html">GLView</a> * </td>
<td class="paramname"> <em>View</em></td><td> </td>
</tr>
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<td></td>
<td>)</td>
<td></td><td></td><td></td>
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<dl><dt><b>Parameters:</b></dt><dd>
<table border="0" cellspacing="2" cellpadding="0">
<tr><td valign="top"></td><td valign="top"><em>App</em> </td><td>the application. </td></tr>
<tr><td valign="top"></td><td valign="top"><em>View,:</em> </td><td>an optional already existing <a class="el" href="classgcu_1_1GLView.html">GLView</a> instance. </td></tr>
</table>
</dd>
</dl>
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</div>
<a class="anchor" id="a18d808656b023683ab3fb24a51c7f993"></a><!-- doxytag: member="gcu::Chem3dDoc::~Chem3dDoc" ref="a18d808656b023683ab3fb24a51c7f993" args="()" -->
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<td class="memname">virtual gcu::Chem3dDoc::~Chem3dDoc </td>
<td>(</td>
<td class="paramname"></td>
<td> ) </td>
<td><code> [virtual]</code></td>
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<p>Default destructor </p>
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<hr/><h2>Member Function Documentation</h2>
<a class="anchor" id="af05ba220e27dd4d471783f802ca30134"></a><!-- doxytag: member="gcu::Chem3dDoc::Draw" ref="af05ba220e27dd4d471783f802ca30134" args="(Matrix const &m) const " -->
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<td class="memname">void gcu::Chem3dDoc::Draw </td>
<td>(</td>
<td class="paramtype"><a class="el" href="classgcu_1_1Matrix.html">Matrix</a> const & </td>
<td class="paramname"> <em>m</em></td>
<td> ) </td>
<td> const<code> [virtual]</code></td>
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<dl><dt><b>Parameters:</b></dt><dd>
<table border="0" cellspacing="2" cellpadding="0">
<tr><td valign="top"></td><td valign="top"><em>m</em> </td><td>the <a class="el" href="classgcu_1_1Matrix.html">Matrix</a> giving the current model orientation</td></tr>
</table>
</dd>
</dl>
<p>Displays the molecule using OpenGL. </p>
<p>Implements <a class="el" href="classgcu_1_1GLDocument.html#a3157e47c92cd1df3a901f39c48914cad">gcu::GLDocument</a>.</p>
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<a class="anchor" id="a113332852c6d5a17993ef623e9852b51"></a><!-- doxytag: member="gcu::Chem3dDoc::GetTitle" ref="a113332852c6d5a17993ef623e9852b51" args="()" -->
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<td class="memname">const char* gcu::Chem3dDoc::GetTitle </td>
<td>(</td>
<td class="paramname"></td>
<td> ) </td>
<td><code> [inline]</code></td>
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<dl class="return"><dt><b>Returns:</b></dt><dd>the title of the molecule if any. </dd></dl>
<p>Reimplemented from <a class="el" href="classgcu_1_1Document.html#ae5df8a6d33cb17e0d61274a561fb8f18">gcu::Document</a>.</p>
<p>Definition at line <a class="el" href="chem3ddoc_8h_source.html#l00109">109</a> of file <a class="el" href="chem3ddoc_8h_source.html">chem3ddoc.h</a>.</p>
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<a class="anchor" id="aa80f903c7660afa78e48c1929e04b486"></a><!-- doxytag: member="gcu::Chem3dDoc::IsEmpty" ref="aa80f903c7660afa78e48c1929e04b486" args="()" -->
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<td class="memname">bool gcu::Chem3dDoc::IsEmpty </td>
<td>(</td>
<td class="paramname"></td>
<td> ) </td>
<td><code> [inline]</code></td>
</tr>
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<dl class="return"><dt><b>Returns:</b></dt><dd>true if the molecule have no atom, false otherwise. </dd></dl>
<p>Definition at line <a class="el" href="chem3ddoc_8h_source.html#l00088">88</a> of file <a class="el" href="chem3ddoc_8h_source.html">chem3ddoc.h</a>.</p>
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<a class="anchor" id="a732761f38f0f5bcf32469533f9cbe038"></a><!-- doxytag: member="gcu::Chem3dDoc::Load" ref="a732761f38f0f5bcf32469533f9cbe038" args="(char const *uri, char const *mime_type)" -->
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<td class="memname">void gcu::Chem3dDoc::Load </td>
<td>(</td>
<td class="paramtype">char const * </td>
<td class="paramname"> <em>uri</em>, </td>
</tr>
<tr>
<td class="paramkey"></td>
<td></td>
<td class="paramtype">char const * </td>
<td class="paramname"> <em>mime_type</em></td><td> </td>
</tr>
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<td></td>
<td>)</td>
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<dl><dt><b>Parameters:</b></dt><dd>
<table border="0" cellspacing="2" cellpadding="0">
<tr><td valign="top"></td><td valign="top"><em>uri</em> </td><td>the uri of the molecule file. </td></tr>
<tr><td valign="top"></td><td valign="top"><em>mime_type</em> </td><td>the mime type of the molecule file.</td></tr>
</table>
</dd>
</dl>
<p>Loads a molecule from the provided uri using OpenBabel. </p>
</div>
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<a class="anchor" id="ad32dd5ccfc336b4d7f5eb70e40135a5e"></a><!-- doxytag: member="gcu::Chem3dDoc::LoadData" ref="ad32dd5ccfc336b4d7f5eb70e40135a5e" args="(char const *data, char const *mime_type)" -->
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<td class="memname">void gcu::Chem3dDoc::LoadData </td>
<td>(</td>
<td class="paramtype">char const * </td>
<td class="paramname"> <em>data</em>, </td>
</tr>
<tr>
<td class="paramkey"></td>
<td></td>
<td class="paramtype">char const * </td>
<td class="paramname"> <em>mime_type</em></td><td> </td>
</tr>
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<td></td>
<td>)</td>
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<dl><dt><b>Parameters:</b></dt><dd>
<table border="0" cellspacing="2" cellpadding="0">
<tr><td valign="top"></td><td valign="top"><em>data</em> </td><td>the inline data. </td></tr>
<tr><td valign="top"></td><td valign="top"><em>mime_type</em> </td><td>the mime type of the data.</td></tr>
</table>
</dd>
</dl>
<p>Loads a molecule from the provided data using OpenBabel. </p>
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<a class="anchor" id="a3115aa51c6004c187a0ef627c6d16248"></a><!-- doxytag: member="gcu::Chem3dDoc::OnExportVRML" ref="a3115aa51c6004c187a0ef627c6d16248" args="(std::string const &filename)" -->
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<td class="memname">void gcu::Chem3dDoc::OnExportVRML </td>
<td>(</td>
<td class="paramtype">std::string const & </td>
<td class="paramname"> <em>filename</em></td>
<td> ) </td>
<td></td>
</tr>
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<dl><dt><b>Parameters:</b></dt><dd>
<table border="0" cellspacing="2" cellpadding="0">
<tr><td valign="top"></td><td valign="top"><em>filename</em> </td><td>the name of the vrml file to which the data should be written.</td></tr>
</table>
</dd>
</dl>
<p>Exports the embedded molecule as a vrml scene. </p>
</div>
</div>
<hr/>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="chem3ddoc_8h_source.html">chem3ddoc.h</a></li>
</ul>
</div>
<hr size="1"/><address style="text-align: right;"><small>Generated on Sun Sep 6 18:33:55 2009 for The Gnome Chemistry Utils by
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