"Absolute binding free energies for octa-acids and guests in SAMPL5 - ..."

Florentina Tofoleanu et al. (2017)

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DOI: 10.1007/S10822-016-9965-5

access: closed

type: Journal Article

metadata version: 2025-05-01

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Florentina Tofoleanu, Juyong Lee, Frank C. Pickard IV, Gerhard König, Jing Huang, Minkyung Baek, Chaok Seok, Bernard R. Brooks:
Absolute binding free energies for octa-acids and guests in SAMPL5 - Evaluating binding free energies for octa-acid and guest complexes in the SAMPL5 blind challenge. J. Comput. Aided Mol. Des. 31(1): 107-118 (2017)

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