Hi Simon,
Often times I do modification of ligand geometries in reel specially if you
have double and triple bond in your ligand.
HTH,
shya
On Mon, Mar 12, 2012 at 12:43 PM, Simon Kolstoe
Hi there,
Who's the best person to talk to when phenix.elbow is not assigning correct geometry to a molecule?
Thanks,
Simon
--------------------------------------------------------------- Dr Simon Kolstoe Laboratory for Protein Crystallography Wolfson Drug Discovery Unit University College London Rowland Hill Street, London NW3 2PF
Tel: 020 7433 2765 http://www.ucl.ac.uk/~rmhasek ---------------------------------------------------------------
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