Mike Henry

Results 108 issues of Mike Henry

Now that espaloma is on conda-forge, we can modify the install instructions to install espaloma from conda-forge (but `dgl` is not so that will require another channel to still get...

For `episodes/11-practice-teaching.md` it would be nice to have a visual aid of the "Organize your feedback along two axes: positive vs. opportunities for growth (sometimes called “negative”) and content (what...

this is just to see if we can get https://github.com/choderalab/openmmtools/pull/712 tested

## Description This PR adds openmm 8 to the testing matrix ## Todos - [ ] Implement feature / fix bug - [ ] Add [tests](https://github.com/choderalab/openmmtools/tree/master/openmmtools/tests) - [ ] Update...

## Description Provide a brief description of the PR's purpose here. ## Todos - [ ] Implement feature / fix bug - [ ] Add [tests](https://github.com/choderalab/openmmtools/tree/master/openmmtools/tests) - [ ] Update...

The workflow file for our CI could be cleaned up, the matrix is clunky, we can use a default for the shell, should switch to pytest

@ijpulidos do you remember which test(s) we disabled because of this bug?