[Dock-fans] Setting 'Anchor' and 'Rigid' Atom Sets
Scott Brozell
sbrozell at rci.rutgers.edu
Tue Apr 7 11:43:50 PDT 2009
Hi,
On Tue, 7 Apr 2009, Mohd Afiq Hazlami wrote:
> Hi. I need some help. Is there any other way to set anchor and rigid atom
> sets without using Sybyl? And is it necessary to set the anchor and rigid
> atom on every ligand molecule's that I'm going to use?
I do not understand the questions. Note that
Manual Specification of Non-rotatable Bonds
is not currently available:
http://dock.compbio.ucsf.edu/DOCK_6/dock6_manual.htm#ManualSpecificationofNonrotatableBonds
If that does not answer your question then send more details and context.
> Can't I just use
> Chimera or other converting tools to create a mol2 file for the ligands?
Yes, that certainly is the normal route.
Scott
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