From owner-chemistry@ccl.net Sun Jul 20 16:33:01 2008 From: "spitaleri.andrea__hsr.it" To: CCL Subject: CCL: free program for conformation searching Message-Id: <-37376-080720072030-30045-gccLWVHxExQ0RrOUIeEBBw(!)server.ccl.net> X-Original-From: Content-Language: en Content-Type: multipart/mixed; boundary="--14c060161d996b71" Date: Sun, 20 Jul 2008 12:08:48 +0200 MIME-Version: 1.0 Sent to CCL by: [spitaleri.andrea=hsr.it] This is a multi-part message in MIME format. ----14c060161d996b71 Content-Type: text/plain; charset=us-ascii Content-Disposition: inline Content-Transfer-Encoding: 7bit Hi there, have look either to tinker or openeye. regards and Andrea Spitaleri PhD Dulbecco Telethon Institute c/o DIBIT Scientific Institute Biomolecular NMR, 1B4 Via Olgettina 58 20132 Milano (Italy) Tel: 0039-0226434348/5622/3497/4922 Fax: 0039-0226434153 ----- Original Message ----- > From: "gnli gnli*_*dicp.ac.cn" Date: Sunday, July 20, 2008 6:52 am Subject: CCL: free program for conformation searching > Dear CCLer, > > Can anyone recommend me some free charge program doing monte carlo > conformation searching, i.e. giving a initial structure, it can > find those > energy lowest conformations under the absolute configuration. > > Easier to be learned is better. > > Any advice is appreciated. > > > > best wishes > Guanna Li > gnli.#%#.dicp.ac.cn > > > > > > > > ******************************************************************** Sostieni la ricerca del San Raffaele con il 5permille! E' SEMPLICE E NON COSTA NULLA. Basta indicare nell'apposito riquadro della dichiarazione dei redditi ("Finanziamento agli enti della ricerca sanitaria") il codice fiscale della Fondazione Centro S. Raffaele del Monte Tabor: 03 06 42 80 153 e ricordarsi di firmare. Se vuoi saperne di piu' scrivi a 5permille#%#hsr.it o vai sul sito www.5xmille.org ----14c060161d996b71 Content-Type: text/x-vcard; name="spitaleri.andrea.vcf"; charset="iso-8859-1" Content-Disposition: attachment; filename="spitaleri.andrea.vcf" Content-Description: Card for Content-Transfer-Encoding: quoted-printable begin=3Avcard n=3ASpitaleri=3BAndrea fn=3AAndrea Spitaleri tel=3Bfax=3A+390226434153 org=3ADibit Scientific Insititute=3BBioMolecular Structure adr=3A=3B=3Bvia Olgettina 58=3BMilan=3B=3B24132=3BItaly version=3A2=2E1 email=3Binternet=3Aspitaleri=2Eandrea=40hsr=2Eit title=3ADr end=3Avcard ----14c060161d996b71--