Mike Henry

Results 357 comments of Mike Henry

Worked fine for me

Firefox 43.0.3 First you will need to open up "Script Editor"

I was going to ask about the same thing, another mechanism to consider is https://docs.aws.amazon.com/AWSEC2/latest/WindowsGuide/UsingAlarmActions.html#AddingTerminateActions Perhaps during the `start-runner` we can use some of the AWS API to setup an...

I ran into this issue as well. Adding this to my docker compose fixed it: ``` sysctls: - net.ipv6.conf.all.disable_ipv6=0 ``` See https://github.com/haugene/docker-transmission-openvpn/issues/960#issuecomment-590058410

That looks reasonable, I would say that you are better off with `except KeyError` so that you only catch that exception instead of maybe something else that could be thrown....

If you could upload the analysis notebook generated using this command: http://getyank.org/latest/analysis.html#visual-analysis we might be able to spot what is giving you trouble.

I would try running longer, it looks like the complex phase took awhile to equilibrate, ![image](https://user-images.githubusercontent.com/11765982/176219170-93ac8177-9582-4f5e-936a-436e1c7b5120.png) so most of the sampling data is discarded. Try running 1000 iterations instead of...

Thanks for the PR! :tada: Sorry it took so long for me to trigger these tests to run!

I think we just need to cut a new release of `openmmtools` since this PR should fix the namespace issues and work with both openmm =7.6 https://github.com/choderalab/openmmtools/pull/528 I'll see what...

That will fix when the issue comes from OpenMMTools, I've got this PR https://github.com/choderalab/yank/pull/1263 to fix spots where yank imports openmm, but I need to fix the CI