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Cheminformatics (also
known as
chemoinformatics)
refers to the use of
physical chemistry theory with
computer and
information science techniques—so called...
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research is
based on the use of datamining,
statistical analysis and
chemoinformatic techniques, a
recent and
innovative international concept registered...
- 2010).
Handbook of
Chemoinformatics Algorithms.
Chapman & Hall. ISBN 978-1420082920.
Johann Gasteiger (November 2003).
Chemoinformatics. Wiley-VCH. ISBN 3527306811...
- Pollastri, G.; Baldi, P. (2013). "Deep
Architectures and Deep
Learning in
Chemoinformatics: The
Prediction of
Aqueous Solubility for Drug-Like Molecules". Journal...
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Molsketch Repository github.com/hvennekate/Molsketch
Written in C++
Operating system Windows,
Linux Available in
English Type
Chemoinformatics License GPL 2.0...
- Representation:
Algorithmic Generation and Conversion".
Handbook of
Chemoinformatics. pp. 51–79. doi:10.1002/9783527618279.ch4. ISBN 978-3-527-30680-0....
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modeling Random graph theory of
gelation Molecular Descriptors for
Chemoinformatics, by R.
Todeschini and V. Consonni, Wiley-VCH, Weinheim, 2009. Mathematical...
- Sadowski, Jens (2005). "Structure
Modification in
Chemical Databases".
Chemoinformatics in Drug Discovery.
Methods and
Principles in
Medicinal Chemistry. pp...
- Ruth (24
October 2011). "Mining the
ChEMBL Database: An
Efficient Chemoinformatics Workflow for ****embling an Ion Channel-Focused
Screening Library"....
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Chemistry Development Kit, an open
source chemical expert system for
chemoinformatics and bioinformatics,
written in Java
Chronic kidney disease, a progressive...
