rdkit
Cheminformatics toolkit for molecular analysis and design. Perform SMILES/SDF parsing, descriptor calculation (LogP, TPSA), fingerprinting, substructure searching, and chemical reaction modeling using RDKit.
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637 skills found
Cheminformatics toolkit for molecular analysis and design. Perform SMILES/SDF parsing, descriptor calculation (LogP, TPSA), fingerprinting, substructure searching, and chemical reaction modeling using RDKit.
An agent-first, zero-based envelope budgeting CLI for tracking finances with SQLite or Turso/libSQL backends.
Visual web workspace for roadmap management, providing interactive kanban boards and graph-based dependency views for task planning and project progress tracking.
A framework for an LLM-based NetHack agent that dynamically synthesizes Python code in a secure sandbox to perform complex dungeon exploration and gameplay actions via a high-level API.
Generate, maintain, and validate OpenAPI 3.1 specifications for RESTful APIs. Streamline documentation, SDK generation, and contract compliance.
Expert SwiftUI development assistant: refactor code, improve performance, and diagnose app hitches or CPU issues using Xcode Instruments trace analysis.
Implement production-grade AI agents with LangGraph, tool-calling guardrails, SSE streaming, and episodic memory. Includes anti-patterns, fix pairs, and stateful architecture patterns.
Generate complete, accessible colour systems from a single hex. Includes 11-shade scales (50-950), semantic tokens, dark mode variants, and Tailwind v4 CSS output.
Upstash Vector DB setup, semantic search, namespaces, and embedding models. Ideal for building high-performance vector search features in Next.js 16/Vercel projects.
Reverse engineer web APIs by capturing browser traffic (HAR files) and generating production-ready Python API clients for automation and data extraction.
Enforces a strict evidence-before-assertion protocol for coding agents, requiring fresh command-line verification output before any claim of completion, success, or bug fixes.
Analyze C++ code for real-time safety violations including heap allocations, locks, blocking calls, and non-deterministic operations in high-performance audio threads.