Chemoinformatics

- QSAR (Quantitative Structure-Activity Relationship)​

- Machine Learning ( Deep Learning)

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CADD (Computer Aided Drug Design)

- Molecular Docking

1. improving docking score

2. pKa calculation of ligands

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- MD Simulation

1. Binding Affinity Calculation 

2. Membrane Simulation 

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- Protein Structure Analysis

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Deep Learning Cooperation

- 건기원

- 기계과

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