From 26f94e8ab36565fe1d8f387482b18a0935d7791a Mon Sep 17 00:00:00 2001 From: kmlefran Date: Thu, 5 Sep 2024 11:22:31 -0400 Subject: [PATCH] Remove problem character --- paper.md | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/paper.md b/paper.md index a9015ce..004cc68 100644 --- a/paper.md +++ b/paper.md @@ -95,7 +95,7 @@ Table 1: Main workflows provided by `aiida-aimall`, their `aiida` entry points t ## Controllers to limit computer burden when running large numbers of jobs -The last main contribution of `aiida-aimall` is through the definition of

`FromGroupSubmissionController`s from the `aiida-submission-controller` package. These controllers limit active processes and can be used together as +The last main contribution of `aiida-aimall` is through the definition of controllers from the `aiida-submission-controller` package. These controllers limit active processes and can be used together as demonstrated in [a tutorial notebook](https://aiida-aimall.readthedocs.io/en/latest/tutorials/controllers.html)) to automate the entire `SubstituentParameterWorkchain`. These use a number of `Workchains` developed just for their use in these controllers. The process flows as `SmilesToGaussianController` -> `AIMAllReorController` -> `GaussianController` -> `AIMAllController`. The latter two controllers can also be seen and used as general use controllers wrapping `GaussianCalculations` and `AimqbCalculations` # Acknowledgements