Commit 13b0f4bb authored by McDonnell, Marshall's avatar McDonnell, Marshall
Browse files

Adds readme for run_gsas.sh

parent d4d7e248
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Original line number Diff line number Diff line
@@ -15,6 +15,13 @@ docker build -t asrp-gsas2-refinement .

# Usage

First, you can use the top-level script to build + run for testing!
```
bash ./run_gsas.sh
```

Otherwise, you can manually do the quikstart via below.

Test:
```
docker run --entrypoint="" asrp-gsas2-refinement pixi run pytest