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Spectral-Hub

An Excellent Toolkit for Spectral Benchmark.

What is Spectral-Hub?

Spectral-Hub is a comprehensive toolkit designed for chemical spectroscopy benchmark testing and model evaluation.

Key Features

  • 🔬 Multiple Spectroscopy Types: Support for IR, Raman, NMR spectroscopy
  • 🤖 Pre-trained Models: Ready-to-use models for various spectral analysis tasks
  • 📊 Benchmark Suite: Standardized evaluation metrics and datasets
  • 🚀 Easy to Use: Simple API for quick integration

Quick Start

python
import spectral_hub as sh

# Load a dataset
data = sh.load_dataset('ir_spectra')

# Create and train a model
model = sh.SpectralModel()
model.train(data)

# Evaluate performance
results = model.evaluate()

Get Started

Released under the MIT License