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MayaChemTools   http://www.mayachemtools.org  [ Edit ]  Site Reviews(2) ...MayaChemTools, a collection of command line Perl scripts to manipulate SD and CSV/TSV text files, is available as free software; you can redistribute it and/or modify it under the terms of the GNU LGPL.... Added: Dec 1, 2004  Last Update: Dec 1, 2004  Category: File format tools  Hits In: 0  Hits Out: 1442

C. U. Shah College Of Pharmac & Research   http://www.ccprvbt.org  [ Edit ]  Site Reviews(1) ...The C. U. Shah College Of Pharmacy & Research is committed to the education of professional and graduate students who, upon graduation, can meet the public need for safe and effective pharmaceutical care. ... Added: Feb 4, 2006  Last Update: Feb 4, 2006  Category: Universities / Colleges  Hits In: 0  Hits Out: 1102

ChIN (Chemical Information Network)   http://chin.csdl.ac.cn/SPT--Home.php?gLanguageCode=1  [ Edit ]  Site Reviews(0) ...ChIN is a comprehensive web guide or directory of Internet chemical resources started in 1997 and is running as the Chemistry Portal, Chinese National Science Digital Library (CSDL) since 2002. More than 10,000 web sites or pages carefully selected by ChIN team were indexed in ChIN and are accessible both in Chinese and English.... Added: Feb 4, 2006  Last Update: Feb 4, 2006  Category: Web Portals  Hits In: 0  Hits Out: 1161

ORCA   http://ewww.mpi-muelheim.mpg.de/bac/logins/downloads_en.php  [ Edit ]  Site Reviews(0) ...The program ORCA is a modern electronic structure program package written by F. Neese, with contributions from U. Becker, F. Wennmohs, D. Ganiouchine and T. Petrenko. The binaries of ORCA are available free of charge for academic users for a variety of platforms.... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: QC / ab initio  Hits In: 0  Hits Out: 1204

Advances Pharma Algorithms   http://www.ap-algorithms.com/admetox_web.htm  [ Edit ]  Site Reviews(0) ...Provide a variety of programs for prediction of ADME/Tox properties.... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: Commercial  Hits In: 0  Hits Out: 1086

AutoBuild   http://81.178.7.83/inter/interprobe.html  [ Edit ]  Site Reviews(0) ...Combinatorial Generation of Chemical Structures... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: Drug Des,Sim Search,Descriptors  Hits In: 0  Hits Out: 1365

PerlMol - Perl Modules for Molecular Chemistry   http://www.perlmol.org/  [ Edit ]  Site Reviews(1) ...PerlMol is a collection of Perl modules for chemoinformatics and computational chemistry with the philosophy that "simple things should be simple". It should be possible to write one-liners that use this toolkit to do meaningful "molecular munging". The PerlMol toolkit provides objects and methods for representing molecules, atoms, and bonds in Perl; doing substructure matching; and reading and writing files in various formats. ... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: Chemical Information Handling  Hits In: 0  Hits Out: 1569

SENECA   http://almost.cubic.uni-koeln.de/jrg/software/seneca/  [ Edit ]  Site Reviews(1) ...SENECA is a program package for Computer Assisted Structure Elucidation (CASE). It attempts to find the constitution of an unknown molecule upon evidence from spectroscopic data, in particular from NMR.... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: NMR Tools  Hits In: 0  Hits Out: 1138

Crystallography & NMR System (CNS)   http://cns.csb.yale.edu/v1.1/  [ Edit ]  Site Reviews(2) ...Crystallography & NMR System (CNS) is the result of an international collaborative effort among several research groups. The program has been designed to provide a flexible multi-level hierachical approach for the most commonly used algorithms in macromolecular structure determination. Highlights include heavy atom searching, experimental phasing (including MAD and MIR), density modification, crystallographic refinement with maximum likelihood targets, and NMR structure calculation using NOEs, J-coupling, chemical shift, and dipolar coupling data.... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: NMR Tools  Hits In: 0  Hits Out: 1394

CHMIS-C: Herbal Medicine Information System for Cancer Drug Design   http://sw16.im.med.umich.edu/chmis-c/  [ Edit ]  Site Reviews(1) ...A comprehensive herbal medicine information system for cancer (CHMIS-C) has been developed. The current version of the database integrates information on more than 500 anticancer herbal recipes that have been used for the treatment of different types of cancer in clinic, more than 900 individual ingredients, and more than 9000 small organic molecules isolated from herbal medicines. Furthermore, subsidiary databases of literature references and molecular targets have been constructed.... Added: Aug 20, 2005  Last Update: Aug 20, 2005  Category: Databases - Nat.Med./Herbs  Hits In: 0  Hits Out: 1233

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