public void TestPseudoAtom()
{
IPseudoAtom a = new PseudoAtom();
Assert.AreEqual("R", a.Symbol);
Assert.IsNull(a.Point3D);
Assert.IsNull(a.Point2D);
Assert.IsNull(a.FractionalPoint3D);
}
public override void TestPseudoAtom_IAtom()
{
IAtom element = NewChemObject().Builder.NewAtom("C");
IPseudoAtom a = new PseudoAtom(element);
Assert.AreEqual("R", a.Symbol);
Assert.IsNull(a.Point3D);
Assert.IsNull(a.Point2D);
Assert.IsNull(a.FractionalPoint3D);
}
public void TestPseudoAtom_IElement()
{
var element = ChemicalElement.R;
IPseudoAtom a = new PseudoAtom(element);
Assert.AreEqual("R", a.Symbol);
Assert.IsNull(a.Point3D);
Assert.IsNull(a.Point2D);
Assert.IsNull(a.FractionalPoint3D);
}
public void TestPseudoAtom_String()
{
string label = "Arg255";
IPseudoAtom a = new PseudoAtom(label);
Assert.AreEqual("R", a.Symbol);
Assert.AreEqual(label, a.Label);
Assert.IsNull(a.Point3D);
Assert.IsNull(a.Point2D);
Assert.IsNull(a.FractionalPoint3D);
}
public void TestPseudoAtom_String_Point3d()
{
Vector3 point = new Vector3(1.0, 2.0, 3.0);
string label = "Arg255";
IPseudoAtom a = new PseudoAtom(label, point);
Assert.AreEqual("R", a.Symbol);
Assert.AreEqual(label, a.Label);
Assert.AreEqual(point, a.Point3D);
Assert.IsNull(a.Point2D);
Assert.IsNull(a.FractionalPoint3D);
}