From 3ac7bca1a55d3e672cdb9a4b6ea599ba85707e05 Mon Sep 17 00:00:00 2001
From: Jan Janssen <jan-janssen@users.noreply.github.com>
Date: Fri, 18 Oct 2024 08:11:21 +0200
Subject: [PATCH 1/3] Update to 0.6.14

---
 recipe/meta.yaml | 10 +++++-----
 1 file changed, 5 insertions(+), 5 deletions(-)

diff --git a/recipe/meta.yaml b/recipe/meta.yaml
index 2031a01..bde149c 100644
--- a/recipe/meta.yaml
+++ b/recipe/meta.yaml
@@ -1,5 +1,5 @@
 {% set name = "pyiron_atomistics" %}
-{% set version = "0.6.13" %}
+{% set version = "0.6.14" %}
 
 package:
   name: {{ name|lower }}
@@ -7,7 +7,7 @@ package:
 
 source:
   url: https://pypi.io/packages/source/{{ name[0] }}/{{ name }}/{{ name }}-{{ version }}.tar.gz
-  sha256: 9fc86a5694379a11f2e2e5c3934082d1fb37ce2cb5610a98b0c34c48a4587c09
+  sha256: 27dd57b62a3f63db9581a773bd3465eaf9d6e3d059d276943737e87674b24da2
 
 build:
   noarch: python
@@ -45,15 +45,15 @@ requirements:
     - ase >=3.22.1,<=3.23.0
     - atomistics >=0.1.27,<=0.1.32
     - defusedxml >=0.7.0,<=0.7.1
-    - h5py >=3.9.0,<=3.11.0
+    - h5py >=3.9.0,<=3.12.1
     - matplotlib-base >=3.5.3,<=3.9.2
-    - mendeleev >=0.12.0,<=0.17.0
+    - mendeleev >=0.12.0,<=0.18.1
     - mp-api >=0.37.0,<=0.42.2
     - numpy >=1.26.0,<=1.26.4
     - pandas >=2.0.3,<=2.2.3
     - phonopy >=2.20.0,<=2.26.6
     - pint >=0.18,<=0.24.3
-    - pyiron_base >=0.10.0,<=0.10.2
+    - pyiron_base >=0.10.0,<=0.10.4
     - pyiron_snippets >=0.1.3,<=0.1.4
     - pylammpsmpi >=0.2.18,<=0.2.25
     - pyscal3 >=3.2.5,<=3.2.7

From 8f6d759aea4b76e45d064c7849bfad42bb0ea998 Mon Sep 17 00:00:00 2001
From: "conda-forge-webservices[bot]"
 <91080706+conda-forge-webservices[bot]@users.noreply.github.com>
Date: Fri, 18 Oct 2024 06:14:33 +0000
Subject: [PATCH 2/3] MNT: Re-rendered with conda-build 24.9.0, conda-smithy
 3.42.2, and conda-forge-pinning 2024.10.17.15.21.02

---
 .scripts/build_steps.sh |  4 ++--
 azure-pipelines.yml     | 29 +++++++++++++++++++++++++++--
 2 files changed, 29 insertions(+), 4 deletions(-)

diff --git a/.scripts/build_steps.sh b/.scripts/build_steps.sh
index af0b9ac..9123720 100755
--- a/.scripts/build_steps.sh
+++ b/.scripts/build_steps.sh
@@ -73,8 +73,8 @@ else
         --extra-meta flow_run_id="${flow_run_id:-}" remote_url="${remote_url:-}" sha="${sha:-}"
     ( startgroup "Inspecting artifacts" ) 2> /dev/null
 
-    # inspect_artifacts was only added in conda-forge-ci-setup 4.6.0
-    command -v inspect_artifacts >/dev/null 2>&1 && inspect_artifacts || echo "inspect_artifacts needs conda-forge-ci-setup >=4.6.0"
+    # inspect_artifacts was only added in conda-forge-ci-setup 4.9.4
+    command -v inspect_artifacts >/dev/null 2>&1 && inspect_artifacts --recipe-dir "${RECIPE_ROOT}" -m "${CONFIG_FILE}" || echo "inspect_artifacts needs conda-forge-ci-setup >=4.9.4"
 
     ( endgroup "Inspecting artifacts" ) 2> /dev/null
     ( startgroup "Validating outputs" ) 2> /dev/null
diff --git a/azure-pipelines.yml b/azure-pipelines.yml
index ad85a2c..95d88f6 100644
--- a/azure-pipelines.yml
+++ b/azure-pipelines.yml
@@ -2,5 +2,30 @@
 # update the conda-forge.yml and/or the recipe/meta.yaml.
 # -*- mode: yaml -*-
 
-jobs:
-  - template: ./.azure-pipelines/azure-pipelines-linux.yml
\ No newline at end of file
+stages:
+- stage: Check
+  jobs:
+    - job: Skip
+      pool:
+        vmImage: 'ubuntu-22.04'
+      variables:
+        DECODE_PERCENTS: 'false'
+        RET: 'true'
+      steps:
+      - checkout: self
+        fetchDepth: '2'
+      - bash: |
+          git_log=`git log --max-count=1 --skip=1 --pretty=format:"%B" | tr "\n" " "`
+          echo "##vso[task.setvariable variable=log]$git_log"
+        displayName: Obtain commit message
+      - bash: echo "##vso[task.setvariable variable=RET]false"
+        condition: or(contains(variables.log, '[skip azp]'), contains(variables.log, '[azp skip]'), contains(variables.log, '[skip ci]'), contains(variables.log, '[ci skip]'))
+        displayName: Skip build?
+      - bash: echo "##vso[task.setvariable variable=start_main;isOutput=true]$RET"
+        name: result
+        displayName: Export result
+- stage: Build
+  condition: and(succeeded(), eq(dependencies.Check.outputs['Skip.result.start_main'], 'true'))
+  dependsOn: Check
+  jobs:
+    - template: ./.azure-pipelines/azure-pipelines-linux.yml
\ No newline at end of file

From 8e31fd6eda341ddba28ecc117f0de4a58481a5e1 Mon Sep 17 00:00:00 2001
From: Jan Janssen <jan-janssen@users.noreply.github.com>
Date: Fri, 18 Oct 2024 08:15:09 +0200
Subject: [PATCH 3/3] Update meta.yaml

---
 recipe/meta.yaml | 1 +
 1 file changed, 1 insertion(+)

diff --git a/recipe/meta.yaml b/recipe/meta.yaml
index bde149c..dd746c4 100644
--- a/recipe/meta.yaml
+++ b/recipe/meta.yaml
@@ -17,6 +17,7 @@ build:
 requirements:
   host:
     - python >=3.9,<3.13
+    - setuptools
     - pip
     - ase
     - atomistics