From owner-chemistry@ccl.net Wed Jun 25 09:52:00 2014 From: "Alfredo Quevedo maquevedo.unc-.-gmail.com" To: CCL Subject: CCL: diversity set for virtual screening Message-Id: <-50284-140624171130-21035-0VcSQc1rbNeJKU9khmWqHA]~[server.ccl.net> X-Original-From: Alfredo Quevedo Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset=ISO-8859-1; format=flowed Date: Tue, 24 Jun 2014 18:11:19 -0300 MIME-Version: 1.0 Sent to CCL by: Alfredo Quevedo [maquevedo.unc\a/gmail.com] Dear Mannan, you can try the ChEMBL database to search, construct and download you own compunds set kind regards Alfredo El 24/06/2014 3:46, Mannan K malie_03###yahoo.co.in escribió: > Sent to CCL by: "Mannan K" [malie_03*_*yahoo.co.in] > Hi CCLers, > > I want to do a virtual screening against a protein of my interest. > To begin, I would like to start with relatively small diversity set to save some computational time. > Where do I get a diverse chemical set. > or Do i need to prepare a library of my own diverse set? > or Is there any other way to begin? > > Many Thanks for your time, > > Mannan> >