T001+T019: Regenerate READMEs

volkamerlab · Sep 8, 2021 · a27f702 · a27f702
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diff --git a/teachopencadd/talktorials/T001_query_chembl/README.md b/teachopencadd/talktorials/T001_query_chembl/README.md
@@ -39,14 +39,14 @@ Our work here will include finding compounds which were tested against a certain
     * Select target ChEMBL ID
 * Get bioactivity data
     * Fetch and download bioactivity data for target
-    * Freeze bioactivity data to ChEMBL 27
     * Preprocess and filter bioactivity data
 * Get compound data
     * Fetch and download compound data
     * Preprocess and filter compound data
 * Output bioactivity-compound data
     * Merge bioactivity and compound data, and add pIC50 values
     * Draw molecules with highest pIC50
+    * Freeze bioactivity data to ChEMBL 27
     * Write output file
 
 

diff --git a/teachopencadd/talktorials/T019_md_simulation/README.md b/teachopencadd/talktorials/T019_md_simulation/README.md
@@ -13,7 +13,7 @@ __Note__
 
 This talktorial was designed to be used with [Google Colab](https://colab.research.google.com/github/volkamerlab/teachopencadd/blob/1bd7cb0c9f6379aebc0c1a0b1c7413685910cffa/teachopencadd/talktorials/019_md_simulation/talktorial.ipynb). It is also possible to use it on a local computer. However, performing the molecular dynamics simulation may take a considerably long time if no GPU is available.
 
-Also, note that this talktorial **will not run on Windows** for the time being.
+Also, note that this talktorial **will not run on Windows** for the time being (check progress in [this issue](https://github.com/volkamerlab/teachopencadd/issues/136)).
 
 
 ## Aim of this talktorial