public static string Show(
string prompt,
string title,
string initialCid,
MetaTable mt)
{
//if (Instance == null)
Instance = new InputCompoundId(); // always allocate a new class
new JupyterGuiConverter().ConvertFormOrUserControl(Instance);
Instance.Text = title;
Instance.Prompt.Text = prompt;
Instance.CidCtl.Text = initialCid;
Instance.PreviousCid = "";
Instance.QuickStructure.ClearMolecule();
Instance.MetaTable = mt;
if (mt != null && Lex.Eq(mt.Name, MetaTable.SmallWorldMetaTableName))
{
Instance.MetaTable = null; // don't use smallworld db directly since can't retrieve by CID
}
DialogResult dr = Instance.ShowDialog(SessionManager.ActiveForm);
if (dr == DialogResult.OK)
{
return(Instance.CidCtl.Text);
}
else
{
return(null);
}
}
private void BrowseRN_Click(object sender, EventArgs e)
{
EQ.Checked = true;
Cid.Enabled = true;
string prompt = "Enter the " + Qc.ActiveLabel + " to be retrieved";
string title = "Limit " + Qc.ActiveLabel;
string tok = InputCompoundId.Show(prompt, title, Cid.Text, Qc.MetaColumn.MetaTable);
if (tok != null)
{
Cid.Text = tok;
}
return;
}
/// <summary>
/// Retrieve an existing molecule and store in MoleculeControl
/// </summary>
/// <param name="molCtl"></param>
/// <param name="mc"></param>
public static void RetrieveDatabaseStructure(
MoleculeControl molCtl,
MetaColumn mc)
{
MetaTable mt = null;
string cid = "", txt;
txt = "compound id";
if (mc != null)
{
mt = mc.MetaTable;
txt += " (" + mt.KeyMetaColumn.Label + ", etc.)";
}
txt = "Enter the " + txt + " that you want to use as a model.";
while (true)
{
cid = InputCompoundId.Show(txt, "Retrieve Molecule from Database", cid, mt);
if (String.IsNullOrEmpty(cid))
{
return;
}
string molString = InputCompoundId.Molecule.PrimaryValue;
if (String.IsNullOrEmpty(molString))
{
MessageBoxMx.ShowError("Compound number is not in the database, try again.");
continue;
}
MoleculeMx cs = InputCompoundId.Molecule;
cs.RemoveStructureCaption(); // remove any caption
molCtl.SetPrimaryTypeAndValue(cs.PrimaryFormat, cs.PrimaryValue); // set mol
molCtl.SetTemporaryMoleculeTag(cid); // associate the cid in case saved as history/favorite
break;
}
}
