From 3813b284022b7bf3381ff2753a28bd6937844250 Mon Sep 17 00:00:00 2001
From: Michel ML <michelml@Michels-MacBook-Air.local>
Date: Tue, 12 Nov 2024 09:54:15 -0500
Subject: [PATCH] add gh workflow for docker build [skip ci]

---
 .github/workflows/docker-build.yml | 28 ++++++++++++++++++++++++++++
 Dockerfile                         |  2 +-
 scripts/build_rdkitjs.sh           |  4 +++-
 3 files changed, 32 insertions(+), 2 deletions(-)
 create mode 100644 .github/workflows/docker-build.yml

diff --git a/.github/workflows/docker-build.yml b/.github/workflows/docker-build.yml
new file mode 100644
index 00000000..4444f36c
--- /dev/null
+++ b/.github/workflows/docker-build.yml
@@ -0,0 +1,28 @@
+name: Docker Build
+
+on:
+  workflow_dispatch:
+    inputs:
+      semver_version:
+        description: 'Semantic version (e.g. 1.0.0)'
+        required: true
+        type: string
+      rdkit_dash_version:
+        description: 'RDKit Dash version'
+        required: true
+        type: string
+      beta:
+        description: 'Beta flag'
+        required: true
+        type: string
+
+jobs:
+  build:
+    runs-on: ubuntu-latest
+    
+    steps:
+    - uses: actions/checkout@v3
+      
+    - name: Build with NPM
+      run: |
+        RDKIT_DASH_VERSION=${{ inputs.rdkit_dash_version }} SEMVER_VERSION=${{ inputs.semver_version }} BETA=${{ inputs.beta }} NPM_TOKEN=${{ secrets.NPM_TOKEN }} npm run build
\ No newline at end of file
diff --git a/Dockerfile b/Dockerfile
index 777e5286..b4411718 100644
--- a/Dockerfile
+++ b/Dockerfile
@@ -116,4 +116,4 @@ RUN /opt/emsdk/node/*/bin/node tests.js
 # https://docs.docker.com/engine/reference/commandline/build/#custom-build-outputs
 FROM scratch as export-stage
 COPY --from=build-stage /src/rdkit/Code/MinimalLib/demo /
-COPY --from=build-stage /src/rdkit/Code/MinimalLib/docs /
+COPY --from=build-stage /src/rdkit/Code/MinimalLib/docs /
\ No newline at end of file
diff --git a/scripts/build_rdkitjs.sh b/scripts/build_rdkitjs.sh
index 021e3d34..98fb1d7a 100644
--- a/scripts/build_rdkitjs.sh
+++ b/scripts/build_rdkitjs.sh
@@ -1,3 +1,5 @@
+#!/bin/bash
+
 set -e
 
 # Set branch to release
@@ -28,7 +30,7 @@ rm -rf $LEGACY_MINIMALLIB_OUTPUT_PATH
 mkdir -p $LEGACY_MINIMALLIB_OUTPUT_PATH
 
 # Build distribution files
-DOCKER_BUILDKIT=1 docker build --no-cache --platform=linux/amd64 -f Dockerfile --build-arg RDKIT_BRANCH=$RDKIT_BRANCH -o $MINIMALLIB_OUTPUT_PATH .
+DOCKER_BUILDKIT=1 docker build --platform=linux/amd64 -f Dockerfile --build-arg RDKIT_BRANCH=$RDKIT_BRANCH -o $MINIMALLIB_OUTPUT_PATH .
 
 # Make dist files executable
 chmod a+rwx $MINIMALLIB_OUTPUT_PATH/RDKit_minimal.js