samplchallenges / SAMPL6

Challenge inputs, details, and results for the SAMPL6 series of challenges
https://samplchallenges.github.io
MIT License
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Evaluations of logP predictions #74

Closed MehtapIsik closed 5 years ago

MehtapIsik commented 5 years ago

This PR adds the overall analysis of the performance comparison of methods that participated in the SAMPL6 logP challenge.

Analysis results can be found here: https://github.com/MobleyLab/SAMPL6/tree/logP_analysis/physical_properties/logP/analysis

I am working on the README files of analysis/ directory.

MehtapIsik commented 5 years ago

I have completed my analysis and documentation for evaluation of submissions.

davidlmobley commented 5 years ago

Some comments as I browse:

I don't see anything else; I haven't checked everything, but I agree with you we should get this up today. Once the results are out I should also get out an e-mail collecting info on who wants to present at/be in on the virtual workshop and polling about scheduling so we can go ahead with that. So ping me when you've merged, @MehtapIsik .