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Disambiguation of "Mobley, David L."

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SAMPL7 protein-ligand challenge: A community-wide evaluation of computational methods against fragment screening and pose-prediction.

, , , , , , and . J. Comput. Aided Mol. Des., 36 (4): 291-311 (2022)

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David L Dowdey

David L Weakliem

David L Largent

L Solymosi

L Bräuer

 

Other publications of authors with the same name

Blind prediction of solvation free energies from the SAMPL4 challenge., , , and . J. Comput. Aided Mol. Des., 28 (3): 135-150 (2014)The SAMPL6 SAMPLing challenge: assessing the reliability and efficiency of binding free energy calculations., , , , , , , , , and 7 other author(s). J. Comput. Aided Mol. Des., 34 (5): 601-633 (2020)Binding of Small-Molecule Ligands to Proteins: “What You See” Is Not Always “What You Get”, and . Structure, 17 (4): 489 - 498 (2009)A Benchmark of Electrostatic Method Performance in Relative Binding Free Energy Calculations., , and . J. Chem. Inf. Model., 61 (3): 1048-1052 (2021)Predicting binding free energies: frontiers and benchmarks, and . Annual review of biophysics, (2017)Let's get honest about sampling.. J. Comput. Aided Mol. Des., 26 (1): 93-95 (2012)Comparison of affinity ranking using AutoDock-GPU and MM-GBSA scores for BACE-1 inhibitors in the D3R Grand Challenge 4., , , , , , , , , and . J. Comput. Aided Mol. Des., 33 (12): 1011-1020 (2019)Erratum to: Lessons learned from comparing molecular dynamics engines on the SAMPL5 dataset., , , , , , , and . J. Comput. Aided Mol. Des., 31 (8): 777 (2017)Binding Modes of Ligands Using Enhanced Sampling (BLUES): Rapid Decorrelation of Ligand Binding Modes Using Nonequilibrium Candidate Monte Carlo, , , , , , , and . (2017)Alchemical free energy methods for drug discovery: progress and challenges, , , , , and . Current Opinion in Structural Biology, 21 (2): 150 - 160 (2011)