public void SetDesignOperation(ResfileDesignOperation operation, int chainIndex, int aaIndex, IEnumerable <char> letters = null)
{
ResfileAaIdentifier aaIdentifier = new ResfileAaIdentifier(chainIndex, aaIndex);
ResfileAaOperation aaOperation = new ResfileAaOperation(operation, letters);
_operations[aaIdentifier] = aaOperation;
}
public ResfileAaOperation(ResfileDesignOperation operation, IEnumerable <char> letters = null)
{
Operation = operation;
if (letters != null)
{
Letters.Clear();
Letters.AddRange(letters);
}
}
public void SetDesignOperation(IEnumerable <IChain> chains, Selection selection, ResfileDesignOperation operation, IEnumerable <char> aas = null)
{
int chainIndex = 0;
foreach (IChain chain in chains)
{
for (int aaIndex = 0; aaIndex < chain.Count; aaIndex++)
{
if (!selection.Aas.Contains(chain[aaIndex]))
{
continue;
}
SetDesignOperation(operation, chainIndex, aaIndex, aas);
}
chainIndex++;
}
}
