Tool to analyze multiple GCMS qualitative tables
NOCTURNAL: Exploring the dark chemical space. A streamlined computational drug discovery platform from target identification to optimized drug visualization. Featuring a unique molecular optimization algorithm "MutaGen" and an interactive chemical space visualization module "ChemNet". All reinforced behind a modular, fault-tolerant architecture.
Traceable molecular descriptor-space workflows for CLI and Python.
Molecular similarity search tool using RDKit Morgan fingerprints and Tanimoto similarity.
FPSim2 exact-Tanimoto similarity search over the NovoMCP Open Corpus — the reference NOVOMCP_MOLECULE_INDEX_URL service.
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