How to obtain HECSP-NMRScore_P

HECSP-NMRScore_P is a Python package to compute protein chemical shift perturbations induced by ligand binding and further refine protein-ligand complex structures.

This paper describes HECSP-NMRScore_P and its applications

• Yu, Z., Li, P., and Merz, K. M., Jr. (2017) Using Ligand-Induced Protein Chemical Shift Perturbations To Determine Protein-Ligand Structures, Biochemistry. 56, 2349-2362.

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