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From: Sergio R. C. <sru...@gm...> - 2014-09-29 12:30:07
|
Dear Mirko, I am not really sure about what you want to do. rDock is a program for docking small molecules to macromolecules (proteins or RNA). If you need to dock small molecules against small molecules, I am afraid rDock can not help you. Best, Sergio 2014-09-28 13:46 GMT+02:00 mirko busato <mir...@gm...>: > Dear users, > > I am new user, > > I would like to do a virtual screening of 30 or less monomers (ligands) > against a receptor (not a protein but a small molecule for > example beta-agonists, beta blockers and some drugs ) to understand which > monomers are most likely to bind the receptor. > > Could I use rDock in my case? > > Thank you very much, > > Mirko > > > > > > ------------------------------------------------------------------------------ > Meet PCI DSS 3.0 Compliance Requirements with EventLog Analyzer > Achieve PCI DSS 3.0 Compliant Status with Out-of-the-box PCI DSS Reports > Are you Audit-Ready for PCI DSS 3.0 Compliance? Download White paper > Comply to PCI DSS 3.0 Requirement 10 and 11.5 with EventLog Analyzer > > http://pubads.g.doubleclick.net/gampad/clk?id=154622311&iu=/4140/ostg.clktrk > _______________________________________________ > rDock-list-def mailing list > rDo...@li... > https://lists.sourceforge.net/lists/listinfo/rdock-list-def > > |
From: mirko b. <mir...@gm...> - 2014-09-28 11:46:08
|
Dear users, I am new user, I would like to do a virtual screening of 30 or less monomers (ligands) against a receptor (not a protein but a small molecule for example beta-agonists, beta blockers and some drugs ) to understand which monomers are most likely to bind the receptor. Could I use rDock in my case? Thank you very much, Mirko |