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Five basic things you need to know about MarvinSketch
Whether you are in academia or in industry as a chemist, a drawing package is an essential tool in...
Clustering by scaffolds
This post is a tutorial to a new component in IJC, the Tree Table. Do you have some interesting use...
Gostar
Information on SAR, pharmacological effects, toxic properties and clinical outcomes is crucial for...
Hierarchical clustering of chemical structures by maximum common substructures
Cluster analysis has been shown to be successful in the categorization of physico-chemical and...
Scripting Dotmatics Vortex 3
ChemAxon's Calculator (cxcalc) is a really useful command line program in Marvin Beans and JChem...
ZINC-12: A tool for the discovery, prioritization and acquisition of commercially available small molecule reagents for biology
The web interface of the ZINC database (ZINC Is Not Commercial) has been redesigned to simplify the...
Comparison of Nine Programs Predicting pKa Values of Pharmaceutical Substances
Knowledge of the possible ionization states of a pharmaceutical substance, embodied in the pKa...
PBEQ-Solver for online visualization of electrostatic potential of biomolecules
PBEQ-Solver provides a web-based graphical user interface to read biomolecular structures, solve...
GSK's Helium Rises to the Top
Familiarity breeds contempt, it’s said, but not in the case of GlaxoSmithKline’s most recent tool...
JChem for Excel
JChem for Excel allows scientists to use ChemAxon toolkit in Microsoft's familiar spreadsheet...
Chemicalize for WordPress
"Having recently bigged up the Chemicalize system that lets you view any web page or chunk of text...
Developing a JChem based web application for searching compounds in vendor databases
Using JChem Cartridge and JChem Base functionalities a web application was developed for searching...