
2 Mar
2006
2 Mar
'06
11:59 p.m.
On Mar 2, 2006, at 3:47 PM, Eric Pettersen wrote:
print r1.oslIdent(), rmsd(r1.atoms, r2.atoms)
Slight errata. The 'atoms' attribute of Residue isn't guaranteed to return the atoms in any particular order, whereas the 'oslChildren()' method sorts the atoms (based on name and serial number). So, the above line of the Python script should really be: print r1.oslIdent(), rmds(r1.oslChildren(), r2.oslChildren()) --Eric