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Merge branch 'rdkit-rs:main' into refactor-periodic-table
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mvisani authored Oct 16, 2024
2 parents 0ca8902 + a77f1fa commit 4dac24e
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24 changes: 12 additions & 12 deletions .github/workflows/test_suite.yml
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Expand Up @@ -38,14 +38,14 @@ jobs:
run: |
cd /tmp
if [ $(dpkg --print-architecture) = "amd64" ]; then
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz
sudo tar xf rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_09_1_ubuntu_22_04_amd64.tar.gz
sudo tar xf rdkit_2024_09_1_ubuntu_22_04_amd64.tar.gz
else
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz
sudo tar xf rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_09_1_ubuntu_22_04_arm64.tar.gz
sudo tar xf rdkit_2024_09_1_ubuntu_22_04_arm64.tar.gz
fi
sudo mv /tmp/rdkit-Release_2024_03_3/Code /usr/local/include/rdkit
sudo mv /tmp/rdkit-Release_2024_03_3/build/lib/* /usr/lib/
sudo mv /tmp/rdkit-Release_2024_09_1/Code /usr/local/include/rdkit
sudo mv /tmp/rdkit-Release_2024_09_1/build/lib/* /usr/lib/
- name: Install latest stable
uses: actions-rs/toolchain@v1
Expand Down Expand Up @@ -88,14 +88,14 @@ jobs:
run: |
cd /tmp
if [ $(dpkg --print-architecture) = "amd64" ]; then
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz
sudo tar xf rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_09_1_ubuntu_22_04_amd64.tar.gz
sudo tar xf rdkit_2024_09_1_ubuntu_22_04_amd64.tar.gz
else
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz
sudo tar xf rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz
curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_09_1_ubuntu_22_04_arm64.tar.gz
sudo tar xf rdkit_2024_09_1_ubuntu_22_04_arm64.tar.gz
fi
sudo mv /tmp/rdkit-Release_2024_03_3/Code /usr/local/include/rdkit
sudo mv /tmp/rdkit-Release_2024_03_3/build/lib/* /usr/lib/
sudo mv /tmp/rdkit-Release_2024_09_1/Code /usr/local/include/rdkit
sudo mv /tmp/rdkit-Release_2024_09_1/build/lib/* /usr/lib/
- name: Install latest stable
uses: actions-rs/toolchain@v1
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2 changes: 1 addition & 1 deletion Cargo.toml
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@@ -1,6 +1,6 @@
[package]
name = "rdkit"
version = "0.4.11"
version = "0.4.12"
edition = "2021"
authors = ["Xavier Lange <[email protected]>", "Javier Pineda <[email protected]"]
license = "MIT"
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3 changes: 2 additions & 1 deletion README.md
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Expand Up @@ -29,9 +29,10 @@ for simplicity's sake, making it easy to tell which crates are compatible.
Managing multiple crates in a single repository:

rdkit % cargo workspaces version patch
rdkit % cargo publish
rdkit % cd rdkit-sys
rdkit-sys % cargo publish
rdkit-sys % cd ..
rdkit % cargo publish


## Formatting
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2 changes: 1 addition & 1 deletion rdkit-sys/Cargo.toml
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
[package]
name = "rdkit-sys"
authors = ["Xavier Lange ([email protected])", "chrissly31415"]
version = "0.4.10"
version = "0.4.12"
edition = "2021"
license = "MIT"
description = "RDKit CFFI library builder and bindings"
Expand Down

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