JSDraw - SDF List Viewer
Code:
<script type="text/javascript">
var mol = " .... ";
var query = new JsMol();
query.setMolfile(mol);
function filter(molfile, props) {
var target = new JsMol();
target.setMolfile(molfile);
// substructure search
if (!query.substructureMatch(target))
return false;
// full-structure search
//if (!query.fullstructureMatch(target))
// return false;
if (parseFloat(props["logP"]) < 1.9)
return false;
return true;
}
JSDraw2.Table.init("data/sdf4.sdf.txt", { searchable: true, highlight: mol, filter: filter }, 'a');
</script>
Display: (It's editable - double-click to edit.)
Copyright 2022, Scilligence (http://www.scilligence.com/)
License: