>00726       <span class="comment">//if(A_prot_lig_score &amp;&amp; *ligand) (*ligand)-&gt;calc_charge_sums();</span>
<a name="l00727"></a>00727       <span class="keywordflow">return</span> <span class="keyword">true</span>;
<a name="l00728"></a>00728     }
<a name="l00729"></a>00729 
<a name="l00730"></a>00730     <span class="keywordtype">bool</span>
<a name="l00731"></a>00731     get_ligand_fragment(<span class="keyword">const</span> <a class="code" href="classSimSite3D_1_1mol2File.html">mol2File</a>&am