Instant JChem
Create, explore and share chemical data
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Summary
Chemical data management from your desktop
Instant JChem (IJC) is an out-of-the-box tool
that allows scientists to create, manage and analyze chemical
structures and related non-chemical data. It serves as a desktop
application that gives a convenient and straightforward approach to the
analysis of chemical and biological data. Instant JChem is a
database-centric environment that supports query and sorting
functionality, and handles large volumes of data (hundreds of thousands
of structures), both in local and remote databases- without any
additional administration. Its wide ranging functionality includes
customizable database views, integration of library enumeration, and
dynamic population of columns with singular and combined molecular
property and descriptor predictions. |
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Benefits
Why you need Instant JChem
Relational database management tool
Locally supported databases, easily managable schemas, trackable properties and simple sharing
View and search the content of your database
Customizable forms and tables, complex queries, easy export and visualization
Visualization and data analysis
Higlighting data trends with a variety of charts, conditional formatting and data pivoting feature
Customizability
Public API enables the removal of limitations on box products and allows the support of specific use cases.
Web-based extension
Plexus connect enables access to relational databases managed by Instant JChem in an online environment
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Features
Relational database management tool
Instant JChem - using our robust JChem Engine - can support a
wide range of relational databases both locally (Derby is bundled)
and remotely (Oracle, MySQL, PostgreSQL etc.). Schemas
(database
connections) can easily be created and administered,
using the data of
an existing data warehouse or importing your
own data to populate it. (Read more and try data import).
Chemical structures will be brought to a standard form,
and you can add extra fields with various physical-chemical properties.
All this data can be organized into projects, and shared with colleagues
with different roles. All users can organize the data in custom views
based on their own preference.
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Features
View and search the content of the database
The customizable forms and tables in
Instant JChem allow users to exhibit and arrange the data based on
personal needs. Data rows are easy to sort. Building even complex
queries is straightforward in Instant JChem. Duplicate, substructure,
full fragment, fragment and superstructure search methods are supported
(more about querying). Queries and also selected compound lists can be saved for further use. Finally, exporting capabilities offer
to print your results in SD file, MS Excel file, PDF file or any other
text formats. The projects can be visualized in a web browser
environment too, using our Plexus Connect.
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Features
Visualization and data analysis features
The data trends can be highlighted and
visualized directly in Instant JChem, while it provides easy access to
other tools for detailed data analysis.
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Features
Customizability to suit your needs
Public API enables the removal of limitations on box products and allows the support of specific use cases.
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Plexus Connect
Web-based extension
- Plexus Connect is
a powerful web-based extension of Instant JChem. It provides access to
relational databases managed by Instant JChem in an online environment.
Database setup, project management and user administration are through
Instant JChem, making Plexus Connect an easy-to-operate tool for end
users.
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