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AKos GmbH and Biochemfusion developed a inhouse chemical database system based on RDKit and PostgreSQL. This is a multiuser system.
As a supplier of chemicals you might have experienced the following issues:
We offer a database system based on PostgreSQL and RDkit that works under Linux, and works very well in a virtual machine under Windows. The client can be installed on Linux or Windows. We offer as a standard interface to other systems the registration of SDFiles. We support ChemDraw and ISIS/Draw. The supported virtual machines are VMWare and HyperV.
Please ask for a quote, send an email to AKos GmbH |
The standard import functionality and the standard data dictionary might not be what you want. We offer services to adjust the system to your needs. We have a lot of experience cleaning your data before we register them into the system: Structure checker: This application checks the correct valence, weeds out wrong structures Standardizes structures, for instance converts 5 valence nitrogen in 3 valence nitrogen (e.g. uncharged nitro groups gets converted in charged nitro groups) Name checker: This application is able to correct errors in names, i.e. if words are spelled wrong like immidazole instead of imidazole. Such a correction cannot be 100%, but it finds many errors. CAS number checker: This application checks if the CAS Registry Number is a valid CAS number. It finds incorrect assigned CAS numbers. Often the CAS number given is in reality for a salt and not for the parent. We only have access to CAS numbers that are in the public domain, but this are already quite a lot. Data enrichment: This application can add
For certain customers we have applications that provide data directly: Names of potential suppliers for a certain compound. You would like to give some identifier like synonym, CAS Number, AKos Number, IUPAC name, etc. and get quickly a list of suppliers. Get quickly the prices for compounds from other suppliers. Biochemfusion has a long experience on building systems for peptides. The system can be extended to handle peptides sequences with structure modifications. Would you be interested in services, and/or would you be interested in having your full chemical information system. Please send an email to:
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AKos Consulting & Solutions Deutschland GmbH Telephone +49 7627 970068 Fax +49 7627 970067 E-Mail General Information: Back to the homepage of AKos GmbH |
Please have a look at our Consulting offer. We are a small group of Ph.D.s in chemistry, that have a solid background of programming and chemoinformatics technology. We also can access a larger group of programmers in Hungary if the need is required for a larger project. |