Difficulties
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Solution
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User: Unable to
find a compound by name or CAS Registry Number.
Supplier of chemicals:
Offer your customer a way to search by
structure.
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ChemRPS offers
fullstructure, substructure search and similarity search.
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User: Unable to
find a compound.
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Do a similarity
search.
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Unable to add search
functions to your home page.
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Easy to implement
the ketcher structure editor and the search option into your own
website, or use these demo files for a start
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Not many customers
know my supplier web page, why should I have a structure search for
my compounds?
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Integrate your
ChemRPS system with iScienceSearch
(http://isciencesearch.com/iss)
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Installing
cheminformatics software is expensive and requires a lot of
know-how.
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ChemRPS is free! We
provide a Docker container. Installation is very easy.
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Easy to use
cheminformatics software is often not a multi user system.
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ChemRPS is a web
application, anybody who can access the URl can use it.
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ChemRPS does not
show all fields and data from the SDFile.
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We are planning to
implement this function with a yearly maintenance fee.
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I need a low cost
chemical and biological multi- user information system.
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As a consulting
project we can expand ChemRPS into a full-fledged chemical and
biological information system.
The
advantage for you is that you pay only for the customization, but no
license fees because everything is based on open source software.
The system is designed to store small molecules, but we also can
extend this to large molecules, see
PROTEAX.
I read somewhere that we make every 30 minutes an error. Most of
them we catch ourselves, but not all. We control the entering of
assay data, so errors can be avoided, and much more.
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The following is a call
to the scientific community:
Structures and data
are often published in tables that cannot be used for further work.
Data should be published in the form of a database. This is
extremely difficult and requires a lot of know-how.
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With ChemRPS you can
add a link to your publication and users can access your data in a
searchable structure database.
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