private static void WriteHeader(
TextWriter writer, Molecule molecule)
{
writer.Write('\n');
writer.Write(" Written by signature package");
writer.Write('\n');
writer.Write('\n');
int a = molecule.GetAtomCount();
int b = molecule.GetBondCount();
writer.Write($"{a,3:D}{b,3:D} 0 0 0 0 0 0 0 0999 V2000");
writer.Write('\n');
}
public bool Identical(Molecule other)
{
if (this.GetBondCount() != other.GetBondCount())
{
return(false);
}
foreach (var bond in this.bonds)
{
if (other.bonds.Contains(bond))
{
continue;
}
else
{
return(false);
}
}
return(true);
}
public static void WriteToStream(Stream stream, Molecule molecule)
{
try
{
using (var writer = new StreamWriter(stream))
{
WriteHeader(writer, molecule);
for (int i = 0; i < molecule.GetAtomCount(); i++)
{
WriteAtom(writer, molecule, i);
}
for (int i = 0; i < molecule.GetBondCount(); i++)
{
WriteBond(writer, molecule, i);
}
writer.Write("M END");
writer.Write('\n');
}
}
catch (IOException)
{
}
}
