AI Agent Skills

A comprehensive library for computational molecular biology

Create beautiful, publication-quality books and documents from computational content.

Retrieves, versions, and publishes scientific datasets with DataLad and git-annex, and captures computational provenance with datalad run, rerun, and containers-run. Use…

Agentic framework for computational chemistry and materials science workflows

Claude Code skill: make one 3D object perform in your SwiftUI app. SceneKit stages, baked choreography, hand-rolled physics, real shadows.

AlgoTune is a NeurIPS 2025 benchmark made up of 154 math, physics, and computer science problems. The goal is write code that solves each problem, and is faster than exi…