From owner-chemistry[ AT ]ccl.net Thu May 18 13:56:00 2006 From: "D.BIO- Gerard Pujadas gerard.pujadas!=!urv.cat" To: CCL Subject: CCL: AutoDock's parameters for cooper? Message-Id: <-31780-060518134519-25598-Oa3FgK2BgJramveFTF6Efw=-=server.ccl.net> X-Original-From: "D.BIO- Gerard Pujadas" Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset="iso-8859-1" ; format="flowed" Date: Thu, 18 May 2006 19:44:51 +0200 Mime-Version: 1.0 Sent to CCL by: "D.BIO- Gerard Pujadas" [gerard.pujadas-.-urv.cat] Dear CCL list members, we would like to dock some ligands into a receptor that has cooper has a cofactor. Then, I wonder if any of you have the Rij and epsij parameters for Cu-Cu that are suitable for their use with AutoDock v3.05 With many thanks in advances for your help Gerard -- ============================= NOTE: NEW E-MAIL ============================ Dr. Gerard Pujadas Grup de recerca en Nutrigenòmica Dept. Bioquímica i Biotecnologia room 106 Campus de Sant Pere Sescelades e-mail: gerard.pujadas^^urv.cat Univ. Rovira i Virgili phone: 34-977 559565 C/ Marcel·lí Domingo fax: 34-977 558232 43007 Tarragona (CATALONIA) State: Spain (European Union) ===========================================================================