Poky

Poky provides automated computational tools for NMR data analysis, enabling signal detection, resonance assignment, structure calculation, and relaxation/dynamics studies of biomolecules.

Key Features:

• Automation: Implements automated procedures for signal detection, resonance assignment, structure calculation, and relaxation analysis from NMR data.
• Extensibility and Scalability: Supports scripting and batching, automated analysis templates, and user-defined library sets to customize and scale NMR workflows.
• Comprehensive Modules: Includes diverse modules covering signal processing, assignment, structure calculation, and relaxation/dynamics analyses for NMR studies.

Scientific Applications:

• Resonance Assignments: Facilitates accurate mapping of atomic nuclei in complex molecules.
• Structure Calculation: Enables detailed three-dimensional structural analysis of biomolecules to inform function and interaction studies.
• Dynamics Studies: Supports investigation of molecular dynamics and conformational changes over time.

Methodology:

Integrates automation tools for NMR data processing and analysis to reduce manual effort in signal detection, assignment, structure calculation, and relaxation/dynamics workflows.