From f10805ae6545ca8a05c13ed12a3f0e15186ebd9f Mon Sep 17 00:00:00 2001 From: "David W.H. Swenson" <dwhs@hyperblazer.net> Date: Wed, 1 Sep 2021 18:05:31 -0400 Subject: [PATCH 1/2] Add binder environment --- binder/environment.yml | 13 +++++++++++++ 1 file changed, 13 insertions(+) create mode 100644 binder/environment.yml diff --git a/binder/environment.yml b/binder/environment.yml new file mode 100644 index 0000000..ff1ffd0 --- /dev/null +++ b/binder/environment.yml @@ -0,0 +1,13 @@ +name: mini-tutorials +channels: + - conda-forge + - defaults +dependencies: + - jupyter + - nglview + - openmmtools + - openmm + - tqdm + - openpathsampling + - openpathsampling-cli +prefix: /Users/dwhs/miniconda3/envs/mini-tutorials From abcdd4afc346819afa9ebfddb93b9dc35781d5e9 Mon Sep 17 00:00:00 2001 From: "David W.H. Swenson" <dwhs@hyperblazer.net> Date: Wed, 1 Sep 2021 18:19:38 -0400 Subject: [PATCH 2/2] don't forget dill and sqlalchemy! --- binder/environment.yml | 2 ++ 1 file changed, 2 insertions(+) diff --git a/binder/environment.yml b/binder/environment.yml index ff1ffd0..c496c70 100644 --- a/binder/environment.yml +++ b/binder/environment.yml @@ -8,6 +8,8 @@ dependencies: - openmmtools - openmm - tqdm + - dill + - sqlalchemy - openpathsampling - openpathsampling-cli prefix: /Users/dwhs/miniconda3/envs/mini-tutorials