molecule) ready for molecular simulation.&quot;</span>)</div><div class="line"><a name="l00011"></a><span class="lineno">   11</span>&#160;node.addAuthor(name=<span class="stringliteral">&quot;Julien Michel&quot;</span>, email=<span class="stringliteral">&quot;julien.michel@ed.ac.uk&quot;</span>, affiliation=<span class="stringliteral">&quot;University of Edinburgh&quot;</span>)</div><div class="line"><a name="l00012"></a><span class="lineno">   12</span>&#160;node.addAuthor(name=<span class="stringliteral"