PRODRG> Parameter set 'pd/oplsaa' (fftype=3). PRODRG> PRODRG> PRODRG> Starting up PRODRG version AA080110.0555 PRODRG> PRODRG written/copyrighted by Daan van Aalten PRODRG> and Alexander Schuettelkopf PRODRG> PRODRG> Questions/comments to dava@davapc1.bioch.dundee.ac.uk PRODRG> PRODRG> When using this software in a publication, cite: PRODRG> A. W. Schuettelkopf and D. M. F. van Aalten (2004). PRODRG> PRODRG - a tool for high-throughput crystallography PRODRG> of protein-ligand complexes. PRODRG> Acta Crystallogr. D60, 1355--1363. PRODRG> PRODRG> PRODRG> PDB mode detected. PRODRG> Molecule complexity index: 2.00. PRODRG> 6 hydrogen(s) added. PRODRG> Using charge groups. PRODRG> Net charge on molecule: 0.000 PRODRG> 7 partial charges 0 ambiguous PRODRG> 13 bonds 0 ambiguous PRODRG> 19 bond angles 0 ambiguous PRODRG> 6 improper dihedrals 0 ambiguous PRODRG> 26 dihedrals 0 ambiguous PRODRG> Normal program end.