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ChemAxon Portfolio
This presentation will have 2 major parts. In the very first part, David will introduce our major...
Mastering MarvinJS - Drawing tool for Mastering Chemistry
Learning organic chemistry is one of the most challenging tasks an undergraduate can choose to...
Enrichment of Analytical Data by Adding Chemical Information
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ChemAxon and Mestrelab Use Case
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A2B Adenosine Receptor Antagonists with Picomolar Potency
The A2B adenosine receptor (A2BAR) was proposed as a novel target for the (immuno)therapy of cancer...
Hitting a moving target: simulation and crystallography study of ATAD2 bromodomain blockers
We analyze small molecule ligand binding to ATAD2 bromodomain by molecular dynamics and protein...
Performance of combined fragmentation and retention prediction for the identification of organic micropollutants by LC-HRMS
In nontarget screening, structure elucidation of small molecules from high resolution mass...
Aquatic toxicity of several textile dye formulations: Acute and chronic assays with Daphnia magna and Raphidocelis subcapitata
Dyes are widely used in various sectors and can be released into the environment where they persist...
A computer-based prediction platform for the reaction of ozone with organic compounds in aqueous solution: kinetics and mechanisms
Ozonation of secondary wastewater effluents can reduce the discharge of micropollutants by...
A drug pocket at the lipid bilayer–potassium channel interface
Many pharmaceutical drugs against neurological and cardiovascular disorders exert their therapeutic...
Hybrid Pharmacophore Design, Molecular Docking, Synthesis, and Biological Evaluation of Novel Aldimine-Type Schiff Base Derivatives as Tubulin Polymerization Inhibitor
A series of hybrid aldimine-type Schiff base derivatives including trimethoxyphenyl ring and...
Rapid Method Development in Hydrophilic Interaction Liquid Chromatography for Pharmaceutical Analysis
A design-of-experiment (DoE) model was developed, able to describe the retention times of a mixture...