This release adds data for 7 targets: cdk8, eg5, hif2a, pfkfb3, shp2, syk, tnks2 of the Merck fep-benchmark dataset migration to new openforcefield namespace (now compatible with openff-toolkit 0.9.0 and higher) minor changes in metadata For details, please see our documentation Please report bugs, request features, or ask questions through our issue tracker. Please note that there may still be some changes to the API prior to a stable 1.0.0 release
0.7.1 This is the first of our patch releases on our new planned monthly release schedule. Detailed ...
0.14.1 Removal of deprecated API points and bugfix release For the complete release notes, please se...
0.9.1 Minor feature and bugfix release For the complete release notes, please see our documentation ...
0.11.0 Major release adding support for proteins and refactoring the Topology class. For the complet...
This release is identical to 0.1.1 For details, please see our documentation Please report bugs, r...
This version: Finishes migration of many tools from smarty to openforcefield Removes outdated examp...
0.3.0 This release makes several improvements and changes to public API. User feedback indicated a n...
A patch release offering minor bug fixes and quality of life improvements. Bugfixes PR #259: Adds i...
This is a micro release that contains bug fixes, QoL improvements and new features. Note the API is ...
0.8.4 Minor feature and bugfix release For the complete release notes, please see our documentation ...
This is a major release that contains bug fixes, QoL improvements and new features. Note the API is ...
0.7.2 This minor release is intended to provide timely access to recent minor features and bugfixes....
0.9.0 Namespace Migration For the complete release notes, please see our documentation This minor r...
0.10.0 Improvements for force field fitting For the complete release notes, please see our documenta...
0.9.2 Minor feature and bugfix release For the complete release notes, please see our documentation ...
0.7.1 This is the first of our patch releases on our new planned monthly release schedule. Detailed ...
0.14.1 Removal of deprecated API points and bugfix release For the complete release notes, please se...
0.9.1 Minor feature and bugfix release For the complete release notes, please see our documentation ...
0.11.0 Major release adding support for proteins and refactoring the Topology class. For the complet...
This release is identical to 0.1.1 For details, please see our documentation Please report bugs, r...
This version: Finishes migration of many tools from smarty to openforcefield Removes outdated examp...
0.3.0 This release makes several improvements and changes to public API. User feedback indicated a n...
A patch release offering minor bug fixes and quality of life improvements. Bugfixes PR #259: Adds i...
This is a micro release that contains bug fixes, QoL improvements and new features. Note the API is ...
0.8.4 Minor feature and bugfix release For the complete release notes, please see our documentation ...
This is a major release that contains bug fixes, QoL improvements and new features. Note the API is ...
0.7.2 This minor release is intended to provide timely access to recent minor features and bugfixes....
0.9.0 Namespace Migration For the complete release notes, please see our documentation This minor r...
0.10.0 Improvements for force field fitting For the complete release notes, please see our documenta...
0.9.2 Minor feature and bugfix release For the complete release notes, please see our documentation ...
0.7.1 This is the first of our patch releases on our new planned monthly release schedule. Detailed ...
0.14.1 Removal of deprecated API points and bugfix release For the complete release notes, please se...
0.9.1 Minor feature and bugfix release For the complete release notes, please see our documentation ...