Integrating AI with computational chemistry
Consultancy services supporting chemists in navigating and implementing modern computational technologies
Our approach
Expanded target access
Co-folding methods identify binders against novel targets, and capture binding poses requiring protein flexibility that traditional docking tools routinely miss
Feasibility-first engagement
Before undertaking a full engagement, we assess whether the target and available data are likely to yield meaningful results
Hybrid methodology
Combining modern machine learning with well-validated physics-based tools maximises predictive accuracy on your specific targets
About Enlace Bio
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Enlace Bio supports computational and medicinal chemists to address complex challenges in the drug discovery pipeline. We apply a combination of proprietary technology and established open-source tools to provide solutions from early hit identification to lead optimisation.
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Application example: See how we can support virtual screening campaigns for hit identification.