public void CommandCalculate()
{
Console.WriteLine("calculating...");
try
{
IonSet copySet = new IonSet(ionSet);
var ljp = Calculate.Ljp(copySet.ions);
Console.WriteLine(ljp.report);
}
catch (Exception ex)
{
Console.WriteLine("Error: LJP cannot be calculated from current ion set.");
Console.WriteLine();
Console.WriteLine("Technical details:");
Console.WriteLine(ex.StackTrace);
Console.WriteLine();
DisplayIonSet();
}
}
private void IonSetSaveButton_Click(object sender, RoutedEventArgs e)
{
var dlg = new Microsoft.Win32.SaveFileDialog
{
Title = "Save Ion Set",
FileName = "myIonSet",
DefaultExt = ".md",
Filter = "Markdown Files (.md)|*.md"
};
var result = dlg.ShowDialog();
if (result == true)
{
string filePath = System.IO.Path.GetFullPath(dlg.FileName);
var thisSet = new IonSet(ionSet);
thisSet.Save(filePath);
Message("Saved Ion Set", $"Custom ion set containing {thisSet.ions.Count} ions saved in:\n{filePath}");
}
}
public void Test_SaveAndLoad_ValuesAreIdentical()
{
// create an ion set
var ions = new List <Ion>
{
new Ion("Na", +1, 50.11E-4, 11, 22),
new Ion("Cl", -1, 76.31E-4, 33, 44),
new Ion("K", -1, 73.5E-4, 55, 66)
};
// save the ion set to a file
string filePath = System.IO.Path.GetFullPath("testIonSet.md");
IonSet ionSet1 = new IonSet(ions);
ionSet1.Save(filePath);
Console.WriteLine($"saved: {filePath}");
// load the ion set from the file
IonSet ionSet2 = new IonSet(filePath);
// test that both ion sets are equal
Assert.AreEqual(ions.Count, ionSet1.ions.Count);
Assert.AreEqual(ions.Count, ionSet2.ions.Count);
Assert.AreEqual(ionSet1.ions.Count, ionSet2.ions.Count);
for (int i = 0; i < ions.Count; i++)
{
Assert.AreEqual(ions[i].name, ionSet1.ions[i].name);
Assert.AreEqual(ions[i].charge, ionSet1.ions[i].charge);
Assert.AreEqual(ions[i].conductivity, ionSet1.ions[i].conductivity, 1e-10);
Assert.AreEqual(ions[i].c0, ionSet1.ions[i].c0);
Assert.AreEqual(ions[i].cL, ionSet1.ions[i].cL);
Assert.AreEqual(ions[i].name, ionSet2.ions[i].name);
Assert.AreEqual(ions[i].charge, ionSet2.ions[i].charge);
Assert.AreEqual(ions[i].conductivity, ionSet2.ions[i].conductivity, 1e-10);
Assert.AreEqual(ions[i].c0, ionSet2.ions[i].c0);
Assert.AreEqual(ions[i].cL, ionSet2.ions[i].cL);
}
}
private void IonSetLoadButton_Click(object sender, RoutedEventArgs e)
{
var dlg = new Microsoft.Win32.OpenFileDialog
{
Title = "Load Ion Set",
FileName = "myIonSet",
DefaultExt = ".md",
Filter = "Markdown Files (.md)|*.md"
};
var result = dlg.ShowDialog();
if (result == true)
{
string filePath = System.IO.Path.GetFullPath(dlg.FileName);
var loadedIonSet = new IonSet(filePath);
ionSet.Clear();
ionSet.AddRange(loadedIonSet.ions);
Message("Loaded Ion Set", $"Loaded {ionSet.Count} ions from file:\n{filePath}");
dataGrid1.Items.Refresh();
ValidateIonSet();
}
}