Brian Medel-Lacruz

The paper develops GPCRmd-NMR, an integrative platform combining MD simulations and NMR spectroscopy to analyze GPCR dynamics at unprecedented scale.

The paper evaluates hydropathic scoring functions to identify near-native ligand-protein poses using a benchmark dataset of 1000 complexes, achieving 90% predictive accuracy when accounting for conformational stress.

This study investigates rare disease variants in Gs, a G protein, using multidimensional approaches to reveal how mutations affect receptor-Gs coupling and signaling defects.