We design and run computational chemistry workflows that turn complex molecular questions into clear, quantitative answers. Our focus is on free energy perturbation (FEP), ΔΔG predictions, molecular dynamics simulations, and mechanistic modeling for biotech, pharma, and ag-biotech teams.
Whether you’re optimizing a lead series, mapping drug-resistance mutations, or redesigning enzymes, we help you make decisions based on physics-based, reproducible calculations—not guesswork.
We design and run computational chemistry workflows that turn complex molecular questions into clear, quantitative answers. Our focus is on free energy perturbation (FEP), ΔΔG predictions, molecular dynamics simulations, and mechanistic modeling for biotech, pharma, and ag-biotech teams.
Whether you’re optimizing a lead series, mapping drug-resistance mutations, or redesigning enzymes, we help you make decisions based on physics-based, reproducible calculations—not guesswork.