Virtual Engines

Accurate Vitual Engines and Effective Ranking Systems (AVENGERS)



AVENGERS Accelerates Drug Discovery with Accuracy and Efficiency!


Hotspot Analysis

Quantum Mechanical System Analysis (3D-SPIEs)


Hocheol Lim et al. Scientific reports 9.1 (2019): 1-11.

  • VIEW MORE



    • 3D-SPIEs Integrates Hotspot Information from Macromolecules and Ligands!


    Hocheol Lim et al. Scientific reports 10.1 (2020): 1-8.

  • VIEW MORE

    • Affinity Prediction

    Quantum Mechanical Scoring Functions (FMO-TIE)

    Hocheol Lim et al. CSBJ 17 (2019): 1217-1225.

  • VIEW MORE



    • FMO-TIE Outperforms Molecular Mechanical Scoring Functions


    Hocheol Lim et al. IJMS 23.8 (2022): 4438.

  • VIEW MORE

    • "Fast is fine but Accuracy is everything"