void MakeMolecules(string[] textData)
{
_testImporters = new PDBImporter[textData.Length];
for (int i = 0; i < textData.Length; i++)
{
_testImporters[i] = new PDBImporter(textData[i]);
}
}
bool RandomAtomsAreCorrect(PDBImporter importer)
{
PDBAtom testAtom;
for (int i = 0; i < randomAtomsToTestPerStructure; i++)
{
string line = importer.lines[Random.Range(0, importer.lines.Length)];
if (line.Substring(0, 6).Trim().Equals("ATOM"))
{
testAtom = importer.ParseAtom(-1, line);
testAtom.localPosition -= importer.molecule.centerOffset;
PDBAtom realAtom = importer.molecule.atoms.Find(a => a.atomNumber == testAtom.atomNumber);
if (!realAtom.EqualsAtom(testAtom))
{
return(false);
}
// Debug.Log(realAtom.ToString() + " PASSED");
}
}
return(true);
}
bool ResidueSequenceMatchesAtoms(PDBImporter importer)
{
int r = 0;
List <Residue> residues = importer.residueSequence;
List <PDBAtom> atoms = importer.molecule.atoms;
for (int a = 0; a < atoms.Count; a++)
{
if (a > 0 && atoms[a].residueNumber != atoms[a - 1].residueNumber)
{
r++;
}
if (atoms[a].residueType != residues[r])
{
Debug.Log(importer.molecule.pdbID + " " + atoms[a].ToString() + " does not match " + residues[r] + r);
return(false);
}
}
return(true);
}
