Mnova Screen

Mnova Screen is an advanced processing and analysis tool that automates the evaluation of ligand-observed 1D NMR screening experiments in early drug discovery. It analyzes ¹H and ¹⁹F data from experiments such as STD, CPMG, wLOGSY, and T₁ρ, performing peak identification, matching, and ligand categorization using user-defined criteria. Integrated reporting and visualization enable rapid inspection and editing of results, while batch processing and database export streamline decision-making across large fragment or ligand libraries, accelerating hit identification.

Faster Hit Discovery: Automated processing of multiple mixtures and experiment types in one run reduces screening cycle times.

Clarity & Confidence: Intuitive, color-coded views and combined experiment results from complementary NMR experiments provide clear, reliable insights into ligand binding and screening outcome.

Throughput & Consistency: Reusable settings, batch processing, and template-based workflows help standardize screening across campaigns and process larger compound libraries with minimal overhead.

1. Peng, C., Frommlet, A., Perez, M., Cobas, C., Blechschmidt, A., Dominguez, S., Lingel, A. Fast and Efficient Fragment-Based Lead Generation by Fully Automated Processing and Analysis of Ligand-Observed NMR Binding Data. Journal of Medicinal Chemistry 59, 3303-3310 (2016). https://doi.org/10.1021/acs.jmedchem.6b00019