LSA-Bot is a new, powerful kind of Chat-bot focused on Latent Semantic Analysis.
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Apr 5, 2018 - Java
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tanimoto
Here are 11 public repositories matching this topic...
Tool to analyze multiple GCMS qualitative tables
calibration data-analysis mass-spectrometry gcms tanimoto gas-chromatography biofuels functional-groups
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Aug 29, 2024 - Python
Statistical test of similarity between binary data using the Jaccard/Tanimoto coefficients
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Feb 3, 2026 - R
Ultra-fast offline pattern classification engine. 60-200µs, 3MB, zero cloud. Patent Pending
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Feb 9, 2026 - Rust
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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Jan 18, 2026 - Python
Molecular similarity search tool using RDKit Morgan fingerprints and Tanimoto similarity.
python cheminformatics pharmacology fingerprints computational-chemistry drug-discovery rdkit tanimoto molecular-similarity
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Jul 16, 2026 - Python
Traceable molecular descriptor-space workflows for CLI and Python.
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Jun 15, 2026 - Python
Ligand-based virtual screening of EGFR inhibitors using Python, RDKit, Morgan fingerprints, Tanimoto similarity, and the ChEMBL database
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Jul 21, 2026 - Jupyter Notebook
Adaptable structure–activity relationship (SAR) analysis pipeline through Tanimoto similarity and fingerprint-based clustering.
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Apr 18, 2026 - Jupyter Notebook
Tanimoto similarity search over binary fingerprints in Rust. Top-10 over 2.85M ChEMBL molecules at Tanimoto 0.95 in ~2.6 ms, ~7x RDKit's bulk kernel.
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Sep 2, 2026 - Rust
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