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"Extended Metadynamics Protocol for Binding/Unbinding Free Energies of ..."

Jacqueline C. Calderón et al. (2024)

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DOI: 10.1021/ACS.JCIM.3C01574

access: closed

type: Journal Article

metadata version: 2024-01-26

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Jacqueline C. Calderón, Eva Plut, Max Keller, Chiara Cabrele, Oliver Reiser, Francesco L. Gervasio, Timothy Clark:
Extended Metadynamics Protocol for Binding/Unbinding Free Energies of Peptide Ligands to Class A G-Protein-Coupled Receptors. J. Chem. Inf. Model. 64(1): 205-218 (2024)

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