From srheller@gig.usda.gov Mon May 4 12:18:23 1998 Date: Mon, 4 May 1998 12:13:06 -0400 (EDT) From: "Stephen R. Heller" X-Sender: srheller@origin To: chemistry@ccl.net Subject: Software for review Message-ID: Reply-To: "Stephen R. Heller" 4 May, 1998 Subject: Computer Software for Review As the Software Review Editor for the ACS Journal of Chemical Information and Computer Science (JCICS) I often get software for review in the journal. I have four (4) new software products. I am looking for people who are willing to review these software products. In return for the review which is published in JCICS you get to keep the software or database. The review should be completed in 1-3 months. The length of the review is 4-10 double spaced typed pages. Sample reviews can be found in most of the recent issues of JCICS. Please try to give me some (short) reason to choose you over another person. I have tried this approach for about the past six years and it is working reasonably well. (REMINDER: For those who haven't finished your reviews of software sent months and months ago, this last sentence does not apply to you!) As a result, I am continuing this new method to find reviewers using this e-mail/user group system. I reserve the right to abandon this if it is a problem, or inappropriate. I will not notify people if I have found a reviewer. If you don't hear from me within a few days I have chosen someone else to review the particular package. As I get many, many, (too many) replies to this message, please do not respond after 6 May, 1998 (Wednesday), as I am sure the software will be gone by then. I can be reached on Internet (SRHELLER@GIG.USDA.GOV). PLEASE BE SURE TO INCLUDE AN STREET ADDRESS, PHONE, and FAX NUMBER!!! (I often send the software by Federal Express.) Without this information I WILL NOT consider your request. Steve Heller The packages I now have are: 1. NIH SBIR Phase I and II forms software from GDI - Grant Forms (www.grantform.com) 2. LogP dB 3.5 software from ACD Labs (www.acdlabs.com). The ACD/LogP Calculator will accept most neutral structures ontaining 50 or fewer atoms and only the elements H, C, N, O, F, Cl, Br, I through the ChemSketch interface. Then it will calculate n accurate Log P (octanol/water partition coefficients). 3.ChemSketch 3.5 drawing program software from ACD Labs (www.acdlabs.com) (includes Dictionary, Tautomers and 3D Viewer) including Chemsketch, Dictionary, Tautomers and 3D Viewer) 4. NMR Processor 3.5 software from ACD Labs (www.acdlabs.com). This includes Chemsketch, Dictionary, Tautomers and 3D Viewer) Steve Heller Steve Heller, NIST 820 Diamond Avenue, Room 101 Gaithersburg, MD 20899 USA Phone: 301-975-3338 FAX: 301-926-0416 E-mail: srheller@gig.usda.gov WWW: www.hellers.com/~steve From varveri@macedonia.nrcps.ariadne-t.gr Wed May 6 02:29:09 1998 Received: from macedonia.nrcps.ariadne-t.gr for varveri@macedonia.nrcps.ariadne-t.gr by www.ccl.net (8.8.3/950822.1) id BAA20635; Wed, 6 May 1998 01:59:09 -0400 (EDT) Received: from macedonia.nrcps.ariadne-t.gr by macedonia.nrcps.ariadne-t.gr with SMTP (Microsoft Exchange Internet Mail Service Version 5.0.1460.8) id K2TF0H5S; Wed, 6 May 1998 09:00:26 +0300 Message-ID: <354FFC7A.8F2F2524@macedonia.nrcps.ariadne-t.gr> Date: Wed, 06 May 1998 09:00:26 +0300 From: "Dr. F.S. Varveri" X-Mailer: Mozilla 4.04 [en] (WinNT; I) MIME-Version: 1.0 To: chemistry@www.ccl.net Subject: ChemInformatics WWW server updated Content-Type: text/plain; charset=us-ascii Content-Transfer-Encoding: 7bit To those interested: The updated 'Information retrieval in Chemistry' WWW server at http://macedonia.nrcps.ariadne-t.gr is up and running as of last April 5th. Yours, F.S. Varveri Institute of Physical Chemistry NCSR 'Demokritos' P.O. Box 60228, 15310 Aghia Paraskevi Attikis, Greece From raeker@saturn.kent.edu Wed May 6 09:29:24 1998 Received: from saturn.kent.edu for raeker@saturn.kent.edu by www.ccl.net (8.8.3/950822.1) id IAA23273; Wed, 6 May 1998 08:46:58 -0400 (EDT) From: Received: by saturn.kent.edu (AIX 4.1/UCB 5.64/4.03) id AA17352; Wed, 6 May 1998 08:13:27 -0400 Date: Wed, 6 May 1998 08:13:26 -0400 (EDT) To: CCL Subject: CCL: Is CCL working? Message-Id: Mime-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII Sorry for a non CC question but I have nt received any mail from this list for over a week and am checking to see if its still alive. Todd. Dr. Todd J. Raeker Department of Chemistry Theoretical Chemistry Group Kent State University raeker@saturn.kent.edu Kent, OH 44242-0001 http://www.saturn.kent.edu/Raeker Phone (330)-672-2986 "Only skydivers know why the birds sing." From LUNA@WCHUWR.CHEM.UNI.WROC.PL Wed May 6 11:29:28 1998 Received: from gerwazy.chem.uni.wroc.pl for LUNA@WCHUWR.CHEM.UNI.WROC.PL by www.ccl.net (8.8.3/950822.1) id LAA24172; Wed, 6 May 1998 11:28:24 -0400 (EDT) Received: from wchuwr.chem.uni.wroc.pl (wchuwr.chem.uni.wroc.pl [156.17.86.157]) by gerwazy.chem.uni.wroc.pl (8.8.8/8.8.8) with ESMTP id RAA00650 for ; Wed, 6 May 1998 17:30:57 +0200 (MET DST) Received: from ICHUWR/SpoolDir by wchuwr.chem.uni.wroc.pl (Mercury 1.31); 6 May 98 17:28:33 +0200 Received: from SpoolDir by ICHUWR (Mercury 1.31); 6 May 98 17:28:16 +0200 From: "Ludmila Szterenberg" Organization: University of Wroclaw (Chemistry) To: chemistry@www.ccl.net Date: Wed, 6 May 1998 17:28:08 GMT+2 Subject: MO Priority: normal X-mailer: Pegasus Mail v3.40 Message-ID: <2D245F1881@wchuwr.chem.uni.wroc.pl> Dear CCLers, I've heard that it is possible to receive from Gaussian's or Games calculations the molecular orbitals and their atomic character. I cannot find details. Please, help. Ludmila Szterenberg