Releases: aws-samples/drug-discovery-workflows
Releases · aws-samples/drug-discovery-workflows
v2.21.0
v2.20.0
[2.20.0] - 2025-06-06
2.20.0 Changed
- Archive OpenFold workflow
2.20.0 Fixed
- Fix bug related to existing ECR repositories without AWS HealthOmics permission policy
- Fix bug related to new traced_sdpa_esm2_t36_3B_UR50D_fp16.pt parameter file for Chai-1 model
v2.19.0
v2.18.1
[2.18.1] - 2025-03-010
2.18.1 Fixed
- Fixed typo in Boltz-1 parameter URI
v2.18.0
[2.18.0] - 2025-03-07
2.18.0 Added
- Added support for Boltz-1 (Single Sequence Mode)
- Added support for Deepstabp
- Added support for Efficient Evolution
- Added support for Efficient Evolution
- Added support for ProteinMPNN-DDG
- Added support for PEP-Patch
- Added support for AggreScan 3D
v2.17.0
2.17.0 Added
- Added support for OpenFold2
v2.16.0
2.16.0 Added
- Added support for Colabfold-search workflow to generate MSA files.
- Added protein complex prediction workflow.
2.16.0 Changed
- Updated Chai-1 workflow to support MSA, template, and constraint files.
- Updated the indexed Uniref30 data source to S3.
v2.15.1
[2.15.1] - 2025-02-19
2.15.1 Fixed
- Updated container build logic in scripts/testrun.sh
- Added missing modules to README
v2.15.0
v2.14.1
[2.14.1] - 2025-01-29
2.14.1 Fixed
- Added missing region variable to Chai-1 base image.
- Updated container build script to better handle missing remote repository credentials.