From csg.admin- at -amgen.com Tue Mar 4 14:31:10 1997 Received: from castle-smtp.amgen.com for csg.admin #at# amgen.com by www.ccl.net (8.8.3/950822.1) id NAA29356; Tue, 4 Mar 1997 13:27:33 -0500 (EST) Received: by castle-smtp.amgen.com; id KAA19755; Tue, 4 Mar 1997 10:05:02 -0800 Received: from www-int.amgen.com(138.133.10.135) by castle-smtp.amgen.com via smap (V3.1) id xma019718; Tue, 4 Mar 97 10:04:42 -0800 Received: from iago.amgen.com (iago [138.133.10.249]) by www-int.amgen.com (8.8.5/8.8.5) with SMTP id KAA17313 for ; Tue, 4 Mar 1997 10:04:38 -0800 (PST) Received: from amgen.com (amgengate) by iago.amgen.com (5.x/SMI-SVR4) id AA09836; Tue, 4 Mar 1997 10:04:33 -0800 Message-Id: Date: 4 Mar 1997 11:00:30 -0800 From: "csg admin" Subject: CCL-Info needed- substructu To: CHEMISTRY: at :www.ccl.net X-Mailer: Mail*Link SMTP-QM 4.0.0 Mime-Version: 1.0 Content-Type: text/plain; charset="ISO-8859-1"; Name="Message Body" Content-Transfer-Encoding: quoted-printable X-MIME-Autoconverted: from 8bit to quoted-printable by www-int.amgen.com id KAA17313 Mail*Link=AE SMTP CCL:Info needed: substructures search* Hello everyone, I am interested in knowing more about the choice of algorithms and different approaches for efficient chemical substructure searching. Can anyone on the list give me knowledgeable recommendations about: (1) Key recent papers (2) Published algorithms (3) Code in the public domain or available as shareware I will summarise the results for the list. Thank you in advance, =20 Sincerely yours, Toly --=20 ______________________________________________________________________ Anatoli O. Krassavine =20 kras*- at -*nmr1.ioc.ac.ru -------This is added Automatically by the Software-------- -- Original Sender Envelope Address: toly%!at!%nmr1.ioc.ac.ru -- Original Sender From: Address: toly-: at :-nmr1.ioc.ac.ru CHEMISTRY ^at^ www.ccl.net: Everybody | CHEMISTRY-REQUEST ^at^ www.ccl.net: Coordin= ator MAILSERV -8 at 8- www.ccl.net: HELP CHEMISTRY or HELP SEARCH | Gopher: www.ccl.net= 73 Anon. ftp: www.ccl.net | CHEMISTRY-SEARCH "-at-" www.ccl.net -- archive search Web: http://www.ccl.net/chemistry.html=20 ------------------ RFC822 Header Follows ------------------ Received: by amgen.com with ADMIN;3 Mar 1997 16:32:11 -0800 Received: from www-int.amgen.com by dorothy.amgen.com via ESMTP (940816.S= GI.8.6.9/921111.SGI) id QAA04460; Mon, 3 Mar 1997 16:01:44 -0800 Received: from castle-smtp.amgen.com (castle-smtp [138.133.19.51]) by www-int.amgen.com (8.8.5/8.8.5) with SMTP id QAA09992; Mon, 3 Mar 1997 16:01:43 -0800 (PST) Received: by castle-smtp.amgen.com; id QAA21963; Mon, 3 Mar 1997 16:01:42= -0800 Received: from www.ccl.net(128.146.36.5) by castle-smtp.amgen.com= via smap (V3.1) id xma021955; Mon, 3 Mar 97 16:01:04 -0800 Received: for chemistry-request -x- at -x- www.ccl.net by www.ccl.net (8.8.3/950822.1) id SAA22711; Mon, 3 Mar 1997 18:= 36:53 -0500 (EST) X-Authentication-Warning: www.ccl.net: mail set sender to chemist= ry-request ":at:" www.ccl.net using -f Received: from holly.chem.niu.edu for toly[ AT ]nmr1.ioc.ac.ru by www.ccl.net (8.8.3/950822.1) id SAA22541; Mon, 3 Mar 1997 18:= 02:19 -0500 (EST) Received: from holly.chem.niu.edu (localhost [127.0.0.1]) by holly.chem.n= iu.edu (950413.SGI.8.6.12/950213.SGI.AUTOCF) via SMTP id RAA20447 for ; Mon, 3 Mar 1997 17:00:13 -0600 X-Original-Sender: toly ^%at%^ nmr1.ioc.ac.ru Sender: Computational Chemistry List Message-ID: <331B57ED.41C6 /at\nmr1.ioc.ac.ru> Date: Mon, 03 Mar 1997 16:59:57 -0600 From: Anatoli Krassavine X-Mailer: Mozilla 3.0 (X11; I; IRIX 6.3 IP32) To: CHEMISTRY $#at#$ www.ccl.net Subject: CCL:Info needed: substructures search algorithms/approaches Errors-To: ccl:~at~:www.ccl.net Precedence: bulk