Ensemble Analyzer

Scientific Background

  • Theoretical Background

User Guide

  • Installation and Setup
  • Analysis Workflow
  • CLI Tools Reference
  • Protocol Configuration Guide
  • CLI Tools Reference

Tutorial and Examples

  • Quickstart
  • Example 1: Multi-Level Ensemble Refinement
  • Example 2: VCD and ECD Spectra Simulation
  • Example 3: Singlet-Triplet Energy Gap (ΔE S→T)
  • Example 4: Transition State Ensemble Refinement

API Reference

  • API Reference
Ensemble Analyzer
  • Search

© Copyright 2026, Andrea Pellegrini, Paolo Righi, Andrea Mazzanti, Michele Mancinelli.

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