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Christopher Mcclain

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Aug 2026

ProtLID2.0: A Residue-Specific Pharmacophore Framework for Protein-Protein Docking.

ProtLID2.0 is presented, a residue-specific pharmacophore framework that generates coordinate-based interaction preferences from molecular dynamics simulations of single-residue probes at receptor interfaces and uses these preferences to score docked complexes and identify cognate ligands.

S. Grudman, Christopher Mcclain, A. Fiser · 0 citations

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