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Local and Global Models For Predicting Properties of Small Molecules
Which type of model has the most potential for success? The obvious answer is all models that are...
How do predicted pKa and solubility values compare to reality?
Discover why Chemaxon's predictions are well accepted and widely used both in industry settings and...
Cloud calculation exemplified
Augmenting chemical structures with calculated properties using dedicated, secure and scalable...
Calculations you can trust
Chemaxon AWS Calculators and Predictors SaaS services has passed one of Hungary’s leading...
Solubility prediction - Chemaxon's Solubility Predictor
Aqueous solubility for organic compounds is one of the most important physico-chemical properties...
Predicting pKa
One of the most important physicochemical properties of small molecules and macromolecules are the...
Compliance screen of 45M compounds in a weekend
Handling large collections of molecules? You need robust cheminformatics tools to identify...
What Structures are Claimed in Patents? - Use cases for patent literature MMP transformations
The MMP transformations from SureCHEMBL can be used in different ways to create analogues to a seed...
Kanban in Drug Discovery
A multi-dimensional, searchable, and interactive Kanban board can help the project team to get a...
Responding to the Challenge Posed by the Generic Control of Substances
Read how novel homology groups and state-of-the-art Markush search technologies address these...
Calculate on the cloud
In order to increase the flexibility, access and integrability, Calculators and Predictors have...
Stereochemistry in Compound Registration
Table of contents Flat bonds OR structure wedge types OR structure replicates Multiple OR labels...