Skill UI

This skill models the expertise of a senior data scientist, covering the entire data science lifecycle. It provides advanced capabilities in statistical modeling, machine learning (deep learning, XGBoost), predictive analytics, and business intelligence. From raw data exploration (EDA) to deploying production-ready models and creating actionable dashboards, it covers technical depth across Python, R, SQL, and cloud platforms, while applying domain knowledge in finance, marketing, and operations.

A Python materials science library for constructing, analyzing, and converting crystal structures, computing phase diagrams and electronic properties, and integrating with the Materials Project API for high-throughput workflows.

GeoMaster is a comprehensive geospatial science skill that guides remote sensing, GIS, spatial analysis, and machine learning workflows for Earth observation and planetary data projects, covering satellite imagery, vector/raster math, point clouds, terrain, hydrology, and cloud-native data stacks.

Analyzes comprehensive fitness logs to track quantitative trends in volume, intensity, and frequency. It tracks progress across multiple disciplines (running, strength) and correlates exercise metrics with vital health indicators like blood pressure and weight, providing personalized, science-backed training and recovery advice.

A comprehensive Python package providing a unified interface to over 40 major bioinformatics web services and databases. Use it for complex biological workflows, including cross-database querying (e.g., UniProt, KEGG, ChEMBL), identifier mapping, protein sequence retrieval, pathway analysis, and running sequence similarity searches like BLAST. It streamlines data integration from multiple life science resources into consistent Python code.

Datamol provides a simplified, Pythonic abstraction layer over RDKit, making complex molecular operations accessible for chemical data science. It supports core functionalities including SMILES parsing, structure standardization, calculation of molecular descriptors (e.g., LogP, MW), 3D conformer generation, and efficient parallel batch processing. It is ideal for streamlining molecular data handling in drug discovery and chemical research pipelines.

DeepChem is a comprehensive Python library designed for applying machine learning to complex fields like chemistry, materials science, and biology. It enables users to perform molecular property prediction (e.g., ADMET, toxicity), train models using specialized graph neural networks (GNNs), and process diverse molecular formats (SMILES, SDF, FASTA). It provides extensive featurization options, making it foundational for drug discovery and computational chemistry research.

A comprehensive toolkit for advanced geospatial analysis. It covers remote sensing (Sentinel, Landsat), GIS operations (vector/raster/point cloud), spatial statistics, and Machine Learning for Earth Observation. Supports cloud-native workflows, multiple data types, and 8 programming languages, making it ideal for complex scientific research and commercial spatial projects.

A powerful Python library that extends pandas to enable complex spatial operations on vector geometric data. It supports reading and writing diverse formats, including Shapefile, GeoJSON, and GeoPackage. Users can perform advanced GIS tasks such as spatial joins, buffering, overlay analysis, calculating areas, managing Coordinate Reference Systems (CRS), and generating interactive choropleth maps, making it essential for geographic data science projects.

NetworkX is a powerful Python library used for creating, manipulating, and analyzing complex networks and graphs. It supports graph structures (directed/undirected, multi-edges) and provides extensive algorithms for tasks such as finding shortest paths, calculating centrality measures (e.g., PageRank), detecting communities, and simulating various network types (e.g., scale-free, small-world). Ideal for social science, biology, and transportation network modeling.

An end-to-end toolkit designed for analyzing high-density Neuropixels electrophysiology recordings. It implements best practices using SpikeInterface, covering the entire workflow: data loading (SpikeGLX, NWB), preprocessing, motion/drift correction, advanced spike sorting (Kilosort4), quality metric computation, and unit curation (including AI-assisted review). Ideal for neuroscience research.

PyTDC (Therapeutics Data Commons) is an open-science platform providing comprehensive, AI-ready datasets and benchmarks for the entire drug discovery and development pipeline. It supports single-instance prediction (e.g., ADME, toxicity), multi-instance prediction (DTI, DDI, PPI), and novel molecule generation (MolGen). Use this skill for benchmarking machine learning models and predicting complex biomedical properties.