Chem 1.16.8 (2025-11-11) docs, release notes
- Added datasync support for biochemical functions
3 Likes
Power Grid 1.7.13 (2025-11-14) docs, release notes
- Added Forms viewer to the Toolbox
3 Likes
2 Likes
Chem 1.16.9 - 1.16.11 (2025-12-09) docs, release notes
Features:
- Added a kekulize option to molecule-notation conversion functions
- Validated deprotection feature with more precise reactions
Bug fixes:
- R-group analysis: Fixed the functionality to support analysis for specific positions only
1 Like
Bio 2.25.2 - 2.25.9 (2025-10-30) docs, release notes
Features:
- Enabled sequence header for shorter and non-MSA sequences
- Monomer Manager:
- Added checks for both capped and uncapped monomers when matching molecules with libraries
- Added support for matching from multiple source
- Mol-To-Helm converter: Added initial version of Molecules to sequence converter
Bug fixes:
- Fixed saving the Substructure filter in projects with datasync
1 Like
Hit Triage 1.8.0 (2025-12-09) docs, release notes
Features:
- Improved support for collaboration with automatic signaling of changes in campaigns between multiple users
- Campaigns table enhancements:
- Added the ability to sort columns via double-click
- Added the ability to hide or show custom columns in the campaigns table
- Improved styling of icons in the info view
See the automatic signaling of changes in campaigns between users in action:
3 Likes
Power Grid 1.7.15 - 1.7.18 (2025-12-11) docs, release notes
Features:
- Added raw PNG renderer
- #3546: Forms viewer: Added support for sorting by specific column (see Forms viewer sorting for details)
- #3547 Forms viewer: Synchronized color, background color, horizontal alignment, and font with the grid
Bug fixes:
- #3561: Forms viewer: empty int value displays incorrectly
2 Likes
Tutorials 1.10.6 (2025-12-15)
Updated the Scientific Computing tutorials:
Clearer steps, improved UI explanations, and the ability to focus on each workflow stage.
2 Likes
Chem 1.16.12 - 1.16.13 (2025-12-23) docs, release notes
Features:
- Detectors: improved SMILES detection by extending the list of supported characters
- Scaffold Tree: disallowed applying multiple filters to the same column
- Butina clustering: Exposed Python implementation to the Top Menu
2 Likes
Hit Triage 1.9.0 (2025-12-17) docs, release notes
Feature:
- Global V-id system and molecule tracking across multiple campaigns
2 Likes
Chem 1.16.14 (2026-01-05) docs, release notes
Feature:
- Introduced an option to disable post–R-group analysis highlighting
3 Likes
EDA 1.4.12 (2026-01-16) docs, release notes
Features:
- Interactive app for training probabilistic multi-parameter optimization (pMPO) models
- Export pMPO models to MPO desirability profiles
2 Likes
Dendrogram 1.4.6 - 1.4.8 (2026-02-03) docs, release notes
Features:
- Hierarchical clustering:
- Added ability to assign clusters by number or threshold (see Cheminformatics updates for details)
- Enabled resizing of the dendrogram attached to the grid
- Introduced horizontal zooming of dendrogram with mouse wheel and pinch gesture
Bug fixes:
- Grid interactivity issues, including disappearing grid slider
2 Likes
Hit Triage 1.9.1 - 1.9.2 (2026-02-03) docs, release notes
Features:
- Hit Design: Migrated functions to parallel execution
- Hit Design: Introduced a custom comparer for V-id
Bug fixes:
- Fixed issues with table joining
3 Likes
Charts 1.6.2 (2026-02-06): docs, release notes
Features
- Charts: Sankey: Add support for color-coding nodes and links
Bug Fixes
- GROK-19376: Projects: Errors for opening data with radar viewer
- 3221: Charts | Tree: Add configuration to hide overlapping labels
- GROK-19226: Charts | Tree: Failed to load saved layout with attached tree viewer
- GROK-19095: Charts | Radar: Trigger the label formatter when resizing
- GROK-19097, GROK-19098: Charts: Chord: Row Source works incorrectly for some values
- GROK-17788: Globe viewer: Doesn’t react on filtering when rowSource = Filter
- GROK-13833: Charts | Chord: Should respond on selecting groups
- GROK-18757: Charts: Radar: Improve column label visualization to prevent their cutting
- GROK-19035: Charts | Timelines: Range slider breaks in some cases
3 Likes
Bio 2.25.10 – 2.25.12 (2026-02-20) docs, release notes
Features:
- Monomers: Added isotope support
- Monomer libraries:
- Added support for complex R-groups (allyls and others)
- Added more R-group validation and auto-fixing
- Custom notation providers:
- Added support for from-helm converter
- Added HELM workflow support
- Detectors: Improved detection sensitivity for provider-specific notations
2 Likes
Bio 2.25.15 - 2.26.1 (2026-03-04) docs, release notes
Features:
- Antibodies: Introduced support for numbering schemes, highlighting, alignment, liabilities detection, and region extraction
- Added monomer collections support
- Monomer libraries: Improved handling of R-group edge cases
2 Likes
Diff Studio 1.5.0 (2026-03-13) docs
Implemented new methods for solving ODEs:
- Runge-Kutta for non-stiff problems:
- Bogacki-Shampine 3(2)
- Runge-Kutta-Fehlberg 4(5)
- Dormand-Prince 5(4)
- Adams-Bashforth - multistep predictor-correctors of order 4 and 5
- LSODA, CVODE - automatic stiffness detection solvers
1 Like
EDA 1.5.0 (2026-03-13) docs
Probabilistic Multi-Parameter Optimization (pMPO) - Enhancements
-
Added support for both numeric and categorical desirability columns
-
Introduced automatic parameter tuning for streamlined configuration
-
Added option to run pMPO without sigmoidal correction
-
New ROC curve and confusion matrix visualizations for model evaluation
1 Like