Mobley Lab Datasets

Parent: Department of Pharmaceutical Sciences, UCI

eScholarship stats: History by Item for August through November, 2024

ItemTitleTotal requests2024-112024-102024-092024-08
6sd403pzExperimental and Calculated Small Molecule Hydration Free Energies4629411798153
7cf8c6crAdvancing predictive modeling through focused development of model systems to drive new modeling innovations4059719
53n2h10tThe Guthrie Hydration Free Energy Database of Experimental Small Molecule Hydration Free Energies3788129
9p37m6bqPredicting binding free energies: Frontiers and benchmarks (a perpetual review)35616310
2jq8s2zrResults of the 2017 Roadmap survey of the Statistical Assessment of Modeling of Proteins and Ligands (SAMPL) challenge community286877
1d84z259The BLUES Report: Towards fragment binding mode occupancies2217311
27d9s5j9Supporting files for "Is ring breaking feasible in relative binding free energy calculations?"191819
30c9r5qjSupporting files: Approaches for calculating solvation free energies and enthalpies demonstrated with an update of the FreeSolv database171718
6x56p5s9A call for regularly updated review/survey articles: "Perpetual Reviews"17566

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