Using Artificial Intelligence for faster Quantum Mechanical parametrization
By Carlos Cruz and Ana Caballero The success of a ligand-based virtual screening campaign relies on their molecular descriptors, in this sense,
By Carlos Cruz and Ana Caballero The success of a ligand-based virtual screening campaign relies on their molecular descriptors, in this sense,
The application of ligand-based virtual screening (LBVS) is commonly extended in the screening of vast chemical libraries to find novel chemical matter
The technology behind a software is important, but so is how to access it. The user interface (UI) allows users to effectively
For some computational and medicinal chemists, a good graphical user interface (GUI) is essential. It makes it easier to analyze, understand and
We are pleased to announce a new update of our Pharmacelera KNIME nodes. Access to our tools is enhanced with the update
Ligand-based virtual screening is a well-known technique to find hits in the early stages of a drug discovery program. In ligand-based tools,
Commercial chemical libraries have witnessed remarkable growth in recent years, resulting in an unprecedented increase in size and diversity. With advancements in
Ligand-based virtual screening is essential in modern drug discovery workflows and PharmScreen® has been shown to find novel molecules through its unique
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