Uni-Mol Tools - Molecular Property Prediction CLI

Package: cli-anything-unimol-tools Command: python3 -m cli_anything.unimol_tools

Description

Interactive CLI for training and inference of molecular property prediction models using Uni-Mol Tools. Supports 5 task types: binary classification, regression, multiclass, multilabel classification, and multilabel regression.

Key Features

• Project Management: Organize experiments with named projects
• 5 Task Types: Classification, regression, multiclass, multilabel variants
• Model Tracking: Automatic performance history and rankings
• Smart Storage: Analyze usage and clean up underperformers
• JSON API: Full automation support with --json flag

Common Commands