Systemic Evolutionary Chemical Space Exploration for Drug Discovery
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Updated
Sep 2, 2025 - Python
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chemical-space-exploration
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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.
data-science machine-learning bioinformatics parsing cheminformatics prediction bioinformatics-pipeline drug-discovery data-analysis network-analysis datavisualization tanimoto molecular-fingerprints molecular-optimization chemical-space-exploration bioactivity-prediction pharmaceutical-research
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Updated
Jul 31, 2025 - Python
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