# Coupled molecular dynamics and continuum electrostatic method to compute the ionization pKa’s of proteins as a function of pH. Test on a large set of proteins

> Research article (Journal of Biomolecular Structure and Dynamics, 2017) · cited 14× · AI/ML

**Wikidata**: [openalex:W2581430703](https://www.wikidata.org/wiki/openalex:W2581430703)  
**Source**: https://4ort.xyz/entity/coupled-molecular-dynamics-and-continuum-electrostatic-method-to-compute-the-ionization-pkas-of-proteins-as-a-function-o