I am curious to know whether or not you have any indication how long it will take to finish off the current work before work can be analysed?

Thank you very much for contributing to the fightAIDS@home Phase 2.

Experiments 001319-001769 and Experiments 001770-002220 target the large-scale benchmark test of the asynchronous replica exchange protocols using the dateset from the SAMPL4 challenge for predicting binding free energies of HIV intergrase. Originally we expected that each replica reaches the cumulated 2.5M MD steps. Now we reset to 1.5M MD steps and will do the first complete analysis after all replicas have 0.5M steps. We are going to analyze Experiments 001770-002220 in a month and in a few months for Experiments 001319-001769. We hope that the results from the tremendous WCG computing resources outperform the original results from HPC clusters.

Thanks.

JC

Hello ,

Did the "monthly" call with the researchers take place in March ? Any new news or information about the project come out ???

Thanks

gb009761, how did you get your signature to show your statistics like that? Is there a specific script that does that? Seems very interesting how it is done.

Thanks.

Thanks, little mermaid! I'll do that shortly!