Pyiron-contrib

Latest version: v0.1.16

Safety actively analyzes 623541 Python packages for vulnerabilities to keep your Python projects secure.

Scan your dependencies

Page 1 of 2

0.1.16

This released moved all machine learning potential related job classes [pyiron_potentialfit](https://github.com/pyiron/pyiron_potentialfit). Existing projects maybe converted by using the [Project maintenance](https://pyiron-base.readthedocs.io/en/latest/apidoc/pyiron_base.project.maintenance.html#pyiron_base.project.maintenance.LocalMaintenance.update_hdf_types) methods implemented in pyiron_base. Beware that this can take a significant amount of time when converting a large number of jobs. You can speed this up a lot by specifying which job type to look for when calling the maintenance functions. For example to update all `Mlip` jobs you may call

python
pr = Project(...)
pr.maintenance.local.update_hdf_types(hamilton='Mlip')


What's Changed
* Remove potential fitting jobs by pmrv in https://github.com/pyiron/pyiron_contrib/pull/995
* Bump boto3 from 1.34.39 to 1.34.44 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/999
* Bump pyiron-atomistics from 0.4.15 to 0.4.17 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1005
* Bump boto3 from 1.34.44 to 1.34.49 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1006
* Bump pyiron-base from 0.7.8 to 0.7.9 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1004
* Bump matplotlib from 3.8.2 to 3.8.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/997
* [patch] Target a particular tag of the actions repo by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/1008
* Bump boto3 from 1.34.49 to 1.34.69 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1019
* Bump pyparsing from 3.1.1 to 3.1.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1014
* Bump distributed from 2024.2.0 to 2024.3.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1016
* Add the HandyMan by pmrv in https://github.com/pyiron/pyiron_contrib/pull/1002
* Bump moto from 5.0.1 to 5.0.4 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/1021


**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.15...pyiron_contrib-0.1.16

0.1.15

A plethora of dependency updates

What's Changed
* Bump boto3 from 1.34.11 to 1.34.34 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/980
* Bump h5io-browser from 0.0.6 to 0.0.7 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/982
* Bump pyiron-base from 0.7.2 to 0.7.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/986
* Bump pyiron-atomistics from 0.4.11 to 0.4.12 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/987
* Bump pympipool from 0.7.9 to 0.7.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/984
* Switch from mock_s3 to mock_aws by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/988
* Bump moto from 4.2.13 to 5.0.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/985
* Update pyiron_base to 0.7.4 and pyiron_atomistics to 0.4.13 by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/989
* Bump boto3 from 1.34.34 to 1.34.39 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/991
* Bump distributed from 2024.1.1 to 2024.2.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/992
* Bump numpy from 1.26.3 to 1.26.4 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/990
* Bump base, atomistics, and h5io_browser by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/996


**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.14...pyiron_contrib-0.1.15

0.1.14

What's Changed
* unify to max iter by Leimeroth in https://github.com/pyiron/pyiron_contrib/pull/857
* Tinybase: Rework storage interface by pmrv in https://github.com/pyiron/pyiron_contrib/pull/738
* Bump scipy from 1.11.1 to 1.11.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/825
* versioneer update to 0.29 by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/880
* merge main by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/882
* Bump pyparsing from 3.0.9 to 3.1.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/810
* Remove nofiles classes by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/873
* Bump boto3 from 1.28.60 to 1.28.62 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/881
* Remove code now living in pyiron_worklfow by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/883
* Bump pyiron-base from 0.6.7 to 0.6.8 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/893
* Bump moto from 4.2.5 to 4.2.6 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/891
* Bump distributed from 2023.9.3 to 2023.10.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/892
* Bump scikit-image from 0.21.0 to 0.22.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/884
* Bump boto3 from 1.28.62 to 1.28.69 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/895
* Bump moto from 4.2.6 to 4.2.7 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/900
* Bump distributed from 2023.10.0 to 2023.10.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/899
* Bump boto3 from 1.28.69 to 1.28.73 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/898
* add randomization of parameters by Leimeroth in https://github.com/pyiron/pyiron_contrib/pull/901
* Bump boto3 from 1.28.73 to 1.28.78 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/904
* Bump pympipool from 0.7.1 to 0.7.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/903
* Bump matplotlib from 3.8.0 to 3.8.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/902
* add tight layout by Leimeroth in https://github.com/pyiron/pyiron_contrib/pull/905
* correct direction and pass dx by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/897
* Fix to_TrainingStorage function of Atomicrex interface by Leimeroth in https://github.com/pyiron/pyiron_contrib/pull/919
* Update mean-field model by raynol-dsouza in https://github.com/pyiron/pyiron_contrib/pull/911
* Combine conda updates by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/922
* Bump boto3 from 1.28.78 to 1.29.6 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/921
* Bump numpy from 1.26.0 to 1.26.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/906
* Bump scipy from 1.11.3 to 1.11.4 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/917
* Bump pympipool from 0.7.5 to 0.7.6 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/923
* Bump moto from 4.2.9 to 4.2.10 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/924
* Bump boto3 from 1.29.6 to 1.29.7 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/925
* Add generic job factories by pmrv in https://github.com/pyiron/pyiron_contrib/pull/896
* Bump pyiron-base from 0.6.9 to 0.6.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/929
* Bump pyiron-atomistics from 0.3.7 to 0.3.10 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/932
* Bump moto from 4.2.10 to 4.2.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/927
* Bump pympipool from 0.7.6 to 0.7.9 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/931
* Bump boto3 from 1.29.7 to 1.33.6 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/930
* Bump distributed from 2023.11.0 to 2023.12.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/928
* Bump pyiron_base to 0.6.12 by pmrv in https://github.com/pyiron/pyiron_contrib/pull/934
* Bump boto3 from 1.33.6 to 1.33.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/935
* replace linear regression by ridge regression by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/933
* Bump pyiron-base from 0.6.12 to 0.6.13 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/937
* Bump moto from 4.2.11 to 4.2.12 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/939
* Bump distributed from 2023.12.0 to 2023.12.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/940
* Bump boto3 from 1.33.11 to 1.34.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/941
* Bump boto3 from 1.34.3 to 1.34.7 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/942
* Bump pyiron-atomistics from 0.3.12 to 0.4.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/944
* Bump boto3 from 1.34.7 to 1.34.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/945
* Bump seaborn from 0.13.0 to 0.13.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/947
* Remove TrainingContainer.to_dict(), because GenericJob now defines th… by pmrv in https://github.com/pyiron/pyiron_contrib/pull/951
* Bump base and atomistics together by pmrv in https://github.com/pyiron/pyiron_contrib/pull/950
* Bump moto from 4.2.12 to 4.2.13 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/953
* Lpatch tinydata by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/962
* Generalize nbands hack by pmrv in https://github.com/pyiron/pyiron_contrib/pull/967
* call super init by Leimeroth in https://github.com/pyiron/pyiron_contrib/pull/971
* [minor] add longer explanation to not selected potential by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/977
* Update shell notebook by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/978
* Tinybase: New Input/Output, Renamed Executors, Storage/Directory brokering by Project by pmrv in https://github.com/pyiron/pyiron_contrib/pull/949
* Lighten the import of pyiron_contrib by niklassiemer in https://github.com/pyiron/pyiron_contrib/pull/968
* Bump distributed from 2023.12.1 to 2024.1.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/974
* Bump seaborn from 0.13.1 to 0.13.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/975
* Bump pyiron-base from 0.6.20 to 0.6.22 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/961
* Delete .github/delete-merged-branch-config.yml by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/957
* Bump pyiron-atomistics from 0.4.6 to 0.4.10 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/981


**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.13...pyiron_contrib-0.1.14

0.1.12

What's Changed
* Make LAMMPS potential algebraic by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/698
* Return output when calling `run` by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/778
* Clean executor fails by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/777
* Node input as args by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/769
* Run the workhorse CI on _all_ pulls by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/782
* Drop python <3.9 from setup.py by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/802
* Parse output labels automatically by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/770
* Downgrade pyparsing by srmnitc in https://github.com/pyiron/pyiron_contrib/pull/800
* Bump distributed from 2023.5.0 to 2023.7.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/801
* Bump matplotlib from 3.7.1 to 3.7.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/762
* Bump scipy from 1.10.1 to 1.11.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/780


**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.11...pyiron_contrib-0.1.12

0.1.11

What's Changed
* Pin scikit-image to 0.19.3 by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/652
* Single import for workflows by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/645
* Make normal nodes slow by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/648
* Fast nodes by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/646
* More convenient single value nodes by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/654
* Introduce HasChannel by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/655
* Move pre-built node files by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/656
* Attach node packages to workflow by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/657
* Qol workflow reprs by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/658
* QoL: Protect node init keywords by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/660
* Make special workflow nodes more flexible at instantiation by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/661
* Use consistent language for IO by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/663
* Let channels wait by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/662
* Bump boto3 from 1.26.118 to 1.26.129 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/664
* Bump pyiron-base from 0.5.36 to 0.5.37 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/650
* Node status by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/666
* Fail earlier without output labels by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/667
* Move tests to unit folder by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/668
* Add a check if randspg binary is installed by pmrv in https://github.com/pyiron/pyiron_contrib/pull/671
* MTP AL: Read atom species consistently with potential by pmrv in https://github.com/pyiron/pyiron_contrib/pull/676
* Bump typeguard from 3.0.2 to 4.0.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/678
* Bump moto from 4.1.8 to 4.1.9 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/679
* Bump boto3 from 1.26.129 to 1.26.133 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/680
* Add initial implementation for FitsnapJob by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/681
* Update job class dict by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/683
* Refactor the two ways of adding into a single method by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/682
* Bump pyiron-base from 0.5.37 to 0.5.38 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/684
* Bump moto from 4.1.9 to 4.1.10 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/687
* Bump pyiron-atomistics from 0.2.66 to 0.2.67 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/685
* Bump boto3 from 1.26.133 to 1.26.137 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/686
* Use pyiron actions by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/669
* Create __init__.py by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/689
* add `QuasiHarmonicApproximation` in __init__.py by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/690
* Fix child job access bug in QuasiHarmonicApproximation by raynol-dsouza in https://github.com/pyiron/pyiron_contrib/pull/691
* Bump boto3 from 1.26.137 to 1.26.142 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/695
* Bump pyiron-base from 0.5.38 to 0.5.39 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/696
* Bump moto from 4.1.10 to 4.1.11 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/704
* Bump boto3 from 1.26.142 to 1.26.146 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/705
* Add a doc example for workflow inputs and outputs by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/675
* Prepare for executors by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/707
* Make run optional in TrainingContainer.sample by pmrv in https://github.com/pyiron/pyiron_contrib/pull/709
* Bump boto3 from 1.26.146 to 1.26.151 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/713
* Bump pyiron-base from 0.5.39 to 0.6.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/714
* Bump pyiron-atomistics from 0.2.67 to 0.3.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/712
* Allow self in node definition by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/708
* Add a Dask Executor by pmrv in https://github.com/pyiron/pyiron_contrib/pull/718
* Add calc static by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/715
* Add server object to Node and Workflow by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/724
* Update tinybase to latest main by pmrv in https://github.com/pyiron/pyiron_contrib/pull/728
* Tinybase: Reconstructing pyiron_base, just smaller by pmrv in https://github.com/pyiron/pyiron_contrib/pull/609
* Has nodes mixin by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/727
* Bump boto3 from 1.26.151 to 1.26.155 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/720
* Bump pyparsing from 3.0.9 to 3.1.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/719
* Workflow: Refactor io by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/732
* Workflow: Better io by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/735
* Workflow: Remove storage priority by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/736
* Bump moto from 4.1.11 to 4.1.12 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/740
* Bump boto3 from 1.26.155 to 1.26.160 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/741
* Test self capability by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/742
* Workflow: Merge changes I made so far by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/733
* Workflow: Build IO in the property if it doesn't exist already by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/737
* Introduce DirectoryObject and FileObject in Workflow by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/725
* Workflow: Centralize working directory by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/745
* Add pympipool executor by pmrv in https://github.com/pyiron/pyiron_contrib/pull/730
* Update docs by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/753
* Fast by default by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/755
* Data channel value starts as not data by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/754
* Rename classes by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/751
* Fix type hints by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/750
* Workflow: Composition to inheritance by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/748
* Bump boto3 from 1.26.160 to 1.26.165 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/758
* Bump boto3 from 1.26.165 to 1.28.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/763
* Tinybase: Add creators for UX by pmrv in https://github.com/pyiron/pyiron_contrib/pull/734
* Order things for circular graphs by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/761
* Executor submodule by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/765
* More cloudpickle executor by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/767
* Introduce running on an executor by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/760
* New class hierarchy and better readiness checking by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/729
* Make the dot dict contents show up in tab completion by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/768
* Hotfix: represeting NotData by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/776
* Bump pympipool from 0.5.1 to 0.5.4 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/772
* Bump moto from 4.1.12 to 4.1.13 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/773
* Bump pympipool from 0.5.4 to 0.5.5 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/779
* Bump pyiron-base from 0.6.1 to 0.6.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/775
* Bump boto3 from 1.28.1 to 1.28.5 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/785
* Bump pyiron-base from 0.6.1 to 0.6.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/784
* Bump scikit-image from 0.19.3 to 0.21.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/706
* Bump boto3 from 1.28.5 to 1.28.9 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/788
* Bump pympipool from 0.5.5 to 0.5.6 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/787
* Add LAMMPS specific (super quick) drag method by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/794
* Bump moto from 4.1.13 to 4.1.14 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/795
* Bump pyparsing from 3.1.0 to 3.1.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/796
* Bump typeguard from 4.0.0 to 4.1.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/798
* Bump pympipool from 0.5.6 to 0.6.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/799
* Bump boto3 from 1.28.9 to 1.28.15 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/797


**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.10...pyiron_contrib-0.1.11

0.1.8

What's Changed
* Bump boto3 from 1.26.32 to 1.26.37 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/552
* Bump boto3 from 1.26.37 to 1.26.41 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/553
* Bump numpy from 1.24.0 to 1.24.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/555
* Bump seaborn from 0.12.1 to 0.12.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/554
* Compress RandSPG by default by pmrv in https://github.com/pyiron/pyiron_contrib/pull/556
* Set running status correctly by pmrv in https://github.com/pyiron/pyiron_contrib/pull/557
* Allow to include inspected jobs in TrainingContainer by pmrv in https://github.com/pyiron/pyiron_contrib/pull/559
* Add method to plot energy vs nn distance by pmrv in https://github.com/pyiron/pyiron_contrib/pull/558
* Bump boto3 from 1.26.41 to 1.26.45 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/562
* Bump scipy from 1.9.3 to 1.10.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/561
* Bump moto from 4.0.12 to 4.0.13 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/560
* Bump moto from 4.0.13 to 4.1.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/563
* Bump matplotlib from 3.6.2 to 3.6.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/564
* Bump pyiron-base from 0.5.30 to 0.5.31 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/565
* Bump pyiron-atomistics from 0.2.61 to 0.2.62 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/567
* Bump boto3 from 1.26.45 to 1.26.52 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/570
* Version 0 of the i-pi jobs by raynol-dsouza in https://github.com/pyiron/pyiron_contrib/pull/571
* Bump boto3 from 1.26.52 to 1.26.54 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/572
* Generic init by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/583
* Bump moto from 4.1.0 to 4.1.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/582
* Bump numpy from 1.24.1 to 1.24.2 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/580
* Merge main by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/586
* Bump boto3 from 1.26.54 to 1.26.66 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/585
* Remove pre release version install by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/578
* Add new classes which do not use file access by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/584
* Bump boto3 from 1.26.65 to 1.26.69 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/588
* Add Murnaghan Job without files by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/590
* Bump matplotlib from 3.6.3 to 3.7.0 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/593
* Bump moto from 4.1.2 to 4.1.3 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/594
* Bump boto3 from 1.26.69 to 1.26.74 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/595
* Bump pyiron-base from 0.5.31 to 0.5.32 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/581
* LAMMPS: Add support for external MPI communicators by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/589
* Merge master by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/598
* Create pympipool based Master jobs by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/591
* NoFiles: Do not create working directories for GenericMaster jobs by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/599
* Clean up jobs in nofiles by jan-janssen in https://github.com/pyiron/pyiron_contrib/pull/601
* Create functioning QHA by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/369
* Add plotting function to show training errors on a log scale by pmrv in https://github.com/pyiron/pyiron_contrib/pull/596
* Avoid reconstructing atoms in TrainingStorage by pmrv in https://github.com/pyiron/pyiron_contrib/pull/597
* Bump boto3 from 1.26.74 to 1.26.79 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/602
* Bump scipy from 1.10.0 to 1.10.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/592
* Bump boto3 from 1.26.79 to 1.26.84 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/607
* Remove needs for notebook CI job by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/610
* Graph-based pyiron workflows by liamhuber in https://github.com/pyiron/pyiron_contrib/pull/577
* Bump boto3 from 1.26.84 to 1.26.89 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/612
* Bump moto from 4.1.3 to 4.1.4 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/604
* Bump matplotlib from 3.7.0 to 3.7.1 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/605
* Add symprec in quasi harmonic approximation by samwaseda in https://github.com/pyiron/pyiron_contrib/pull/613
* Bump pyiron-atomistics from 0.2.63 to 0.2.64 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/614
* Bump moto from 4.1.4 to 4.1.5 by dependabot in https://github.com/pyiron/pyiron_contrib/pull/617
* change np.int to np.int64 to fix pacemaker job with numpy >=1.24 by srmnitc in https://github.com/pyiron/pyiron_contrib/pull/618

New Contributors
* srmnitc made their first contribution in https://github.com/pyiron/pyiron_contrib/pull/618

**Full Changelog**: https://github.com/pyiron/pyiron_contrib/compare/pyiron_contrib-0.1.6...pyiron_contrib-0.1.8

Page 1 of 2

© 2024 Safety CLI Cybersecurity Inc. All Rights Reserved.