@datagrok-libraries/bio 5.65.1 → 5.65.3

package/CLAUDE.md

@@ -65,9 +65,9 @@ This decouples the library from concrete package implementations, allowing packa
 
 | File | Purpose |
 |---|---|
-| `types.ts` | Re-exports all HELM types from `@datagrok-libraries/helm-web-editor` and `js-draw-lite`: `HelmType`, `HelmAtom`, `HelmBond`, `HelmMol`, `HelmEditor`, `PolymerType`, `MonomerType`, `IHelmWebEditor`, `ISeqMonomer`, `MonomerSetType`, etc. |
+| `types.ts` | Re-exports HELM types from `@datagrok-libraries/helm-web-editor` and `js-draw-lite`: `HelmType`, `HelmAtom` / `Atom` / `IJsAtom`, `HelmBond` / `Bond`, `HelmMol` / `Mol`, `HelmEditor` / `Editor`, `MonomerExplorer`, `PolymerType`, `MonomerType`, `IHelmWebEditor`, `ISeqMonomer`, `MonomerSetType`, `WebEditorRGroups`, `MonomersFuncs`, `TabDescType`, `IBio` / `IHelmBio`, `HelmString`, `Point`, browser-side singletons `HweWindow` / `ScilModuleType` / `JSDraw2ModuleType` / `OrgType` / `DojoType` / `DojoxType` |
 | `consts.ts` | Re-exports `HelmTypes`, `MonomerTypes`, `PolymerTypes`, `MonomerNumberingTypes`, `HelmTabKeys` |
-| `helm-helper.ts` | `IHelmHelper` interface (parse, removeGaps, getMolfiles, createHelmInput, createWebEditorApp), `HelmInputBase` abstract class, `HelmNotSupportedError`, `getHelmHelper()` factory, `getMonomerHandleArgs()` helper. Augments `ui.input` with `helmAsync()` |
+| `helm-helper.ts` | `IHelmHelper` interface — `parse()`, `removeGaps()`, `getMolfiles()`, `createHelmInput()`, `createHelmWebEditor()`, `createWebEditorApp()`, `getHoveredAtom()`, plus monomer-funcs hooks (`originalMonomersFuncs` getter, `buildMonomersFuncsFromLib()`, `overrideMonomersFuncs()` / `revertOriginalMonomersFuncs()`) and `seqHelper` getter. `HelmInputBase` abstract class. `HelmNotSupportedError` (+ `HelmNotSupportedErrorType`). `getHelmHelper()` factory. `getMonomerHandleArgs()` helper. `IHelmInputInitOptions`, `HelmConvertRes` exported. Augments `ui.input` with `helmAsync()` |
 | `utils.ts` | `cleanupHelmSymbol()` — strips brackets from HELM monomer symbols |
 
 ### `molecule/` — 2D Molecule Column Handling
@@ -93,23 +93,23 @@ The core engine for converting macromolecule sequences into V3000 molfiles.
 
 | File | Purpose |
 |---|---|
-| `types.ts` | Core types: `MonomerGraph` (atoms, bonds, R-groups), `MolGraph` (assembled molecule graph), `MonomerMapValue` (atom/bond indices per position), `MonomerSequenceDict`, `SeqToMolfileWorkerInput/Output`, `LibSettings` |
-| `consts.ts` | V2K/V3K parsing tokens, precision factors, canonical nucleotide component symbols (ribose, deoxyribose, phosphate) |
-| `monomer-works.ts` | `MonomerWorks` class — wraps `IMonomerLib`, provides `getMonomerMolfile()`. `helmTypeToPolymerType()` converter |
-| `to-atomic-level.ts` | **Core engine.** `seqColToMolFileColumn()` — converts macromolecule column to molfile column. Handles molfile parsing, V2K→V3K conversion, spatial adjustment (rotation, flipping, coordinate shifting), R-group capping, stereo-center handling, and final V3K assembly |
-| `to-atomic-level-utils.ts` | Molfile assembly engine: `buildMolfileFromSeq()` — chains monomers into a complete V3K molfile. Handles peptide bonds, nucleotide assembly (sugar+phosphate+base), terminal capping |
-| `seq-to-molfile.ts` | Parallel orchestration: `seqToMolfile()` — spawns Web Workers for parallel conversion. `getHighlightMoleculeData()` — builds per-monomer atom/bond coloring for highlights |
-| `seq-to-molfile-worker.ts` | Web Worker entry point — receives sequence chunks, calls `buildMolfileFromSeq()`, posts results back |
-| `monomer-hover.ts` | `addMonomerHoverLink()` — creates hover links between sequence cells and molecule cells with LRU-cached monomer maps. `executeHoverLinks()` / `getHoverLinks()` / `addHoverLink()` |
-| `monomer-utils.ts` | Analytics: `encodeMonomerSymbol()` (Unicode encoding), `getMonomerMolfiles()`, `sdfToJson()` (SDF→HELM library conversion), `calculatePositionChemSimilarity()`, `monomerPairwiseSimilarity()`, `getSubstitutionMatrix()` |
-| `lib-settings.ts` | `loadLibSettings()` / `saveLibSettings()` — user-specific monomer library preferences with chunked storage |
-| `utils.ts` | Small shared helpers: `getAtomicLevelColName()`, `helmTypeToNotation()`, `hexToPercentRgba()` |
+| `types.ts` | Core types: `Atoms` / `Bonds` / `MonomerMetadata` (parsed-molfile data), `MolGraph` (assembled molecule graph) + `MonomerMolGraphMap` + `getMolGraph` / `hasMolGraph` / `setMolGraph` helpers, `LibMonomerKey`, `MonomerMap` / `MonomerMapValue` / `MolfileWithMap`, `LoopVariables` / `LoopConstants` / `NumberWrapper`, `Point`, `ITypedArray`, `UserLibSettings`, `NucleotideRole` enum (`SUGAR` / `BASE` / `PHOSPHATE` / `TERMINAL_5P` / `TERMINAL_3P`), `SeqToMolfileWorkerData` / `SeqToMolfileWorkerRes` |
+| `consts.ts` | `monomerWorksConsts` object — V2K/V3K parsing tokens, `PRECISION_FACTOR`, canonical nucleotide component keys (`RIBOSE` / `DEOXYRIBOSE` / `PHOSPHATE`), `OXYGEN` / `HYDROGEN` element symbols |
+| `monomer-works.ts` | `MonomerWorks` class — wraps `IMonomerLib`, provides `getMonomerMolfile()`. `helmTypeToPolymerType()` converter. `IMolfileConverter` interface |
+| `to-atomic-level.ts` | **Core engine.** `_toAtomicLevel()` — converts macromolecule column to V3000 molfile column. HELM RNA path (triples mode) keeps per-position sugar/base/phosphate (via `getMonomerSequencesArray`, `getMonomersDictFromLib`, `buildRolesForHelmRna`); legacy path uses default ribose/deoxyribose/phosphate. Handles V2K→V3K conversion (`convertMolfileToV3K`, `fixV2000MolfileRAtomLines`), atom/bond block parsing (`parseAtomBlock` is internal; `parseBondBlock`, `parseAtomAndBondCounts`, `parseCapGroups`, `parseCapGroupIdxMap` / `parseCapGroupIdxMapV2K` / `parseCapGroupIdxMapV3K` are exported), R-group capping, stereo-center handling, V3K serialization (`convertMolGraphToMolfileV3K`), capped-monomer rendering (`getSymbolToCappedMolfileMap`, `capPeptideMonomer`). The geometric pipeline (`adjustSugarMonomerGraph`, `adjustPhosphateMonomerGraph`, `adjustBaseMonomerGraph`, `adjustPeptideMonomerGraph`) places R-attached atoms (`terminalNodes`) on the OX axis with R3 / branch up; the sugar branch is overridden so the base is placed above the topmost atom for non-canonical sugars (e.g. LNA's 2,4-bridge). `setShiftsAndTerminalNodes` injects an O at the R1 cap position when the cap is `H` so phosphorothioate-style linkers (sp, en, …) keep a real C-O-P bridging atom |
+| `to-atomic-level-utils.ts` | Molfile assembly engine: `monomerSeqToMolfile()` — chains monomers into a complete V3K molfile (peptide bonds, nucleotide assembly: sugar+base+phosphate, terminal capping). `runTriplesAssembly()` (internal) handles HELM RNA per-row triples including 5'/3' terminal modifiers (Chol / GalNAc / Bio) and missing-trailing-phosphate. `getFormattedMonomerLib()` (lib → per-symbol object map). `keepPrecision()` (coordinate rounding helper) |
+| `seq-to-molfile.ts` | `seqToMolFileWorker()` — orchestrates the molfile column build (single-threaded today; the `Worker` plumbing is wired but disabled — runs synchronously per row). `getMolHighlight()` — builds an `ISubstruct` from per-monomer atom/bond ranges for hover highlights. `SeqToMolfileResult` type |
+| `seq-to-molfile-worker.ts` | Web Worker entry point — receives `SeqToMolfileWorkerData`, calls `monomerSeqToMolfile()`, posts `SeqToMolfileWorkerRes` back |
+| `monomer-hover.ts` | `addMonomerHoverLink()` — wires hover from a sequence cell to a molecule cell with LRU-cached monomer maps. `execMonomerHoverLinks()` / `getMonomerHoverLinks()`. `MonomerHoverLinksTemp` column-tag constant |
+| `monomer-utils.ts` | Analytics: `encodeMonomers()` (Unicode encoding of monomer symbols for cosine-distance use), `getMolfilesFromSeq()` / `getMolfilesFromSingleSeq()` (per-position molfile assembly), `createMomomersMolDict()`, `createJsonMonomerLibFromSdf()` (SDF table → HELM JSON library) |
+| `lib-settings.ts` | `getUserLibSettings()` / `setUserLibSettings()` — user-specific monomer library preferences with chunked storage |
+| `utils.ts` | Small shared helpers: `getUnusedColName()`, `getMolColName()`, `alphabetToPolymerType()`, `hexToPercentRgb()`. `MonomerHoverLink` type |
 
 **Data flow for sequence → molfile conversion:**
-1. `seqColToMolFileColumn()` in `to-atomic-level.ts` is the entry point
-2. It parses monomer molfiles from the library into `MonomerGraph` objects
-3. `seqToMolfile()` in `seq-to-molfile.ts` spawns Web Workers
-4. Each worker (`seq-to-molfile-worker.ts`) calls `buildMolfileFromSeq()` from `to-atomic-level-utils.ts`
+1. `_toAtomicLevel()` in `to-atomic-level.ts` is the entry point. HELM RNA columns stay in triples mode (per-position sugar / base / phosphate); other notations convert to separator first.
+2. It parses monomer molfiles from the library into `MolGraph` objects (`getMonomersDictFromLib` → `getMolGraph` per symbol).
+3. `seqToMolFileWorker()` in `seq-to-molfile.ts` iterates rows.
+4. Each row calls `monomerSeqToMolfile()` from `to-atomic-level-utils.ts`, which threads the row through the geometric assembly loop. The chirality engine (`Chem:convertToV3KViaOCL`) is applied to the resulting column to add `STEABS` blocks.
 
 ### `utils/` — Core Utilities
 
@@ -117,13 +117,15 @@ The core engine for converting macromolecule sequences into V3000 molfiles.
 
 | File | Purpose |
 |---|---|
-| `types.ts` | **Key file.** `ISplitted` (split sequence interface), `INotationProvider` (notation-specific behavior), `SplitterFunc` type, `CandidateType` (alphabet detection), `SeqColStats` / `SeqColStatsCached` |
-| `consts.ts` | **Key file.** `NOTATION` enum (FASTA, SEPARATOR, HELM), `ALIGNMENT` enum, `ALPHABET` enum (DNA, RNA, PT, UN), `TAGS` (column tag names for units, aligned, alphabet, separator, region), `GAP_SYMBOL`, `ALPHABET_CHARS`, regex patterns for FASTA/HELM parsing |
-| `utils.ts` | **Largest utility file.** All `Splitter` implementations: `SplitterBase`, `SplitterFasta`, `SplitterHelm`, `SplitterBiln`. Splitter factory functions. Alphabet detection via cosine similarity. Palette selection. Monomer abbreviation. `getJoiner()`, `getAlphabetSimilarity()`, `getStats()`, `candidateStats()` |
+| `types.ts` | **Key file.** `ISeqSplitted` (split sequence interface) + `SeqSplittedBase`, `INotationProvider` (notation-specific behavior) + `NotationProviderBase`, `SplitterFunc` type, `IMonomerCanonicalizer`, `CandidateType` / `CandidateSimType` (alphabet detection), `MonomerFreqs`, `SeqColStats`, graph types `ISeqConnection` / `ISeqGraphInfo` |
+| `consts.ts` | **Key file.** `NOTATION` enum (FASTA, SEPARATOR, HELM, BILN, CUSTOM), `ALIGNMENT` enum, `ALPHABET` enum (DNA, RNA, PT, UN), `TAGS` enum (column tag names — `units`, `aligned`, `alphabet`, `separator`, `region`, plus also exported as `BioTags`), `Alphabets` namespace (per-alphabet character sets), `GAP_SYMBOL`, `GapOriginals`, `candidateAlphabets`, `monomerRe` / `helmRe` / `helmPp1Re`, `MONOMER_MOTIF_SPLITTER`, `MONOMER_CANONICALIZER_FUNC_TAG` / `MONOMER_CANONICALIZER_TEMP`, `NOTATION_PROVIDER_CONSTRUCTOR_ROLE`, `positionSeparator` |
+| `utils.ts` | **Largest utility file.** Splitter implementations: `StringListSeqSplitted` (separator), `FastaSimpleSeqSplitted`, `HelmSplitted` (with graph info), `BilnSeqSplitted` (cycles/connections). Splitter factory funcs: `splitterAsFasta`, `splitterAsFastaSimple`, `splitterAsHelm`, `splitterAsBiln`, `getSplitterWithSeparator`, `getSplitter`. Alphabet detection: `detectAlphabet`, `detectHelmAlphabet`, `getAlphabet`, `getAlphabetSimilarity`, `getStatsForCol`, `pickUpPalette` / `pickUpSeqCol` / `getPaletteByType`. Monomer abbreviation (`monomerToShort`). HELM helpers: `polymerTypeToHelmType`, `RNA_HELM_TRIPLET_MONOMER_REG`, `RNA_HELM_TERMINAL_PHOSPHATELESS_MONOMER_REG` |
 | `seq-handler.ts` | `ISeqHandler` interface — central abstraction for a macromolecule column: notation, alphabet, separator, splitter/joiner, HELM conversion, region extraction, distance function selection. `SeqValueBase` — wraps a single row value with `getOriginal()`, `getCanonical()`, `helm` |
 | `scoring.ts` | `ScoringMethod` enum + `calculateIdentityScoring()` / `calculateChemSimilarityScoring()` — sequence scoring vs reference |
 | `alignment.ts` | `pairwiseAlignmentWithEmptyPositions()` — Needleman-Wunsch alignment with gap penalties |
-| `monomers.ts` | Precomputed SMILES/fingerprints for 20 amino acids + 5 nucleotides. `calcMonomerFps()`, `matchMonomerToNatural()` |
+| `monomers.ts` | Precomputed SMILES + fingerprints for the 20 amino acids and 5 nucleotides: `naturalMonomers`, `naturalMonomerFps`, `getMorganFingerprint()`, `mostSimilarNaturalAnalog()` |
+| `annotations.ts` | Sequence-annotation type system: `AnnotationVisualType` / `AnnotationCategory` / `LiabilitySeverity` enums, `SeqAnnotation` / `SeqAnnotationHit` interfaces, `RowAnnotationData` row payload, default colors/opacity constants used by the annotation cell-renderer overlay |
+| `numbering-schemes.ts` | Antibody numbering scheme region definitions: `NumberingScheme` / `ChainType` enums, `SchemeRegionDef`, and `IMGT_REGIONS` / `KABAT_REGIONS` / `CHOTHIA_REGIONS` / `AHO_REGIONS` plus `SCHEME_REGIONS` lookup |
 | `index.ts` | Barrel re-exports for the macromolecule module |
 
 #### Cell Rendering
@@ -140,13 +142,18 @@ The core engine for converting macromolecule sequences into V3000 molfiles.
 
 | File | Purpose |
 |---|---|
-| `seq-helper.ts` | `ISeqHelper` interface + `getSeqHelper()` factory. `ISeqHelper` is the primary entry point for sequence operations: `getSeqHandler()`, `setNotationProvider()`, `getMonomersList()`, `helmToSmiles()`, `helmToMolfile()` |
+| `seq-helper.ts` | `ISeqHelper` interface + `getSeqHelper()` factory. `ISeqHelper` is the primary entry point for sequence operations: `helmToAtomicLevel()` / `helmToAtomicLevelSingle()` (column-wide and one-shot HELM → V3K molfile), `getSeqHandler()`, `getSeqMonomers()`, `setUnitsToFastaColumn()` / `setUnitsToSeparatorColumn()` / `setUnitsToHelmColumn()`, `getHelmToMolfileConverter()`. Also exports `ToAtomicLevelRes`, `IHelmToMolfileConverter` |
 | `const.ts` | HELM monomer library JSON schema field names (`HELM_REQUIRED_FIELD`, `HELM_OPTIONAL_FIELDS`, `HELM_RGROUP_FIELDS`), SDF-to-JSON mapping, dummy monomer template, encoding ranges |
-| `splitter.ts` | `joinDataFrames()` — splits aligned sequences into per-position columns |
+| `splitter.ts` | `splitAlignedSequences()` — splits aligned sequences into per-position columns |
 | `composition-table.ts` | `getCompositionTable()` — builds HTML monomer composition bar chart |
 | `fasta-handler.ts` | `FastaFileHandler` — parses FASTA files into DataFrames |
 | `generator.ts` | Test data generators for synthetic macromolecule columns |
-| `sequence-position-scroller.ts` | `SequencePositionScroller` — interactive MSA header with WebLogo tracks, conservation scoring, position slider, composition tooltips (~1600 lines) |
+| `sequence-position-scroller.ts` | MSA header / scroll bar engine: `MSAScrollingHeader`, abstract `MSAHeaderTrack`, plus `WebLogoTrack` and `ConservationTrack` track implementations. Renders sequence-logo + conservation tracks above an MSA grid with a scrollable position slider and composition tooltips |
+| `annotation-track.ts` | `AnnotationTrack` — `MSAHeaderTrack` subclass that overlays region/liability annotations on the MSA scroller |
+| `cell-renderer-annotations.ts` | `AnnotationRenderer` — paints region rectangles and liability underlines on the macromolecule cell renderer |
+| `macromolecule-highlight.ts` | Cross-package monomer highlight bus: `fireMacromoleculeHighlight()`, `setMacromoleculeMonomerHighlight()` / `setMacromoleculeMonomerHighlights()`, `clear*` siblings, `MACROMOLECULE_HIGHLIGHT_EVENT_ID` / `…_TEMP` / `…_ALPHA` constants, `MacromoleculeHighlightEntry` / `EventArgs` / `Colors` / `Target` / `RowSpec` types, `macromoleculeHighlightColorToCss()` |
+| `monomer-selection-dialog.ts` | `MonomerSelectionWidget` + `showMonomerSelectionDialog()` — picker dialog for choosing monomer symbols. `parseMonomerSymbolList()` parses comma/space-separated symbol input |
+| `sequence-column-input.ts` | `ISequenceColumnInput` / `SequenceColumnInputBase` + `createSequenceColumnInput()` — DG input that filters its choices to `Macromolecule` columns and exposes notation/alphabet metadata |
 | `data-provider.ts` | `getDataProviderFuncs()` — discovers registered data provider functions by semtype |
 | `docker.ts` | `awaitStatus()` — polls Docker container status until target state |
 | `syncer.ts` | `Syncer` — serializes concurrent async operations into sequential execution |
@@ -179,8 +186,8 @@ All viewer types follow `IXxxViewer` + property defaults pattern. Implementation
 | `types.ts` | `BiostructureData` type (binary/text with extension), `BiostructureDataJson` namespace for serialization |
 | `pdb-helper.ts` | `IPdbHelper` interface (parse, convert PDB/PDBQT/mol), `PdbAtomDataFrame` typed DataFrame |
 | `auto-dock-service.ts` | `IAutoDockService` interface (docking operations, Docker container management) |
-| `index.ts` | `PdbTag` constant export |
-| `format/` | PDB/PDBQT atom record parsing classes: `AtomRecordBase` → `PdbAtomRecord` / `PdbqtAtomRecord`, with coordinate parsing, chain/residue sorting, TER records |
+| `index.ts` | `TAGS` enum (currently just `TAGS.PDB` = `'.pdb'`) — column-tag identifier used for PDB-bearing data |
+| `format/` | PDB/PDBQT atom record parsing classes. `types-base.ts` defines the abstract `LineBase` and `AtomBase` (with shared coord/residue/chain parsing); `types-pdb.ts` and `types-pdbqt.ts` carry the `Pdb*` / `Pdbqt*` line implementations including TER records and chain/residue sorting; `types.ts` re-exports the public surface |
 
 ### `trees/` — Phylogenetic Tree Handling
 
@@ -198,8 +205,8 @@ All viewer types follow `IXxxViewer` + property defaults pattern. Implementation
 
 | File | Purpose |
 |---|---|
-| `monomer-lib-tests.ts` | `testExpectedMonomerLib()` — validates IMonomerLib against expected polymer type counts |
-| `palettes-tests.ts` | Tests for nucleotide and amino acid palette instantiation |
+| `monomer-lib-tests.ts` | `expectMonomerLib()` — validates `IMonomerLib` against expected polymer type counts |
+| `palettes-tests.ts` | `_testPaletteN()` / `_testPaletteAA()` — palette instantiation tests for nucleotide and amino acid palettes |
 
 ### Other
 
@@ -228,13 +235,14 @@ Monomers follow the Pistoia HELM JSON schema. The library system has three layer
 
 ### Sequence Splitting
 
-Sequences are split into per-position monomers via `SplitterFunc` implementations:
-- `SplitterFasta` — character-level splitting for FASTA notation
-- `SplitterBase` — separator-based splitting
-- `SplitterHelm` — HELM parsing with graph/connection info
-- `SplitterBiln` — BILN notation with cyclization marks
+Sequences are split into per-position monomers via `SplitterFunc` factories returning `ISeqSplitted`:
+- `splitterAsFastaSimple` / `splitterAsFasta` → `FastaSimpleSeqSplitted` — character-level splitting for FASTA notation (the multichar variant handles `[multi]` brackets)
+- `getSplitterWithSeparator` → `StringListSeqSplitted` — separator-based splitting
+- `splitterAsHelm` → `HelmSplitted` — HELM parsing with graph/connection info (`ISeqGraphInfo` exposes per-monomer `polymerTypes`, `cycles`, etc.)
+- `splitterAsBiln` → `BilnSeqSplitted` — BILN notation with cyclization marks
+- `getSplitter(notation, sep)` is the dispatcher used everywhere else
 
-The split result implements `ISplitted` with `getOriginal(pos)`, `getCanonical(pos)`, `isGap(pos)`, `length`.
+The split result implements `ISeqSplitted` with `getOriginal(pos)`, `getCanonical(pos)`, `isGap(pos)`, `length`, plus `graphInfo` on HELM. `SeqSplittedBase` is the abstract base for custom implementations.
 
 ### Cell Rendering Pipeline
 
@@ -256,7 +264,9 @@ Macromolecule grid cell rendering uses a layered async architecture:
 | Macromolecule handler interface (`ISeqHandler`) | `src/utils/macromolecule/seq-handler.ts` |
 | Notation/alphabet/tag constants | `src/utils/macromolecule/consts.ts` |
 | Sequence splitter implementations | `src/utils/macromolecule/utils.ts` |
-| Macromolecule type system (`ISplitted`, `SplitterFunc`) | `src/utils/macromolecule/types.ts` |
+| Macromolecule type system (`ISeqSplitted`, `SplitterFunc`) | `src/utils/macromolecule/types.ts` |
+| Antibody numbering scheme region maps | `src/utils/macromolecule/numbering-schemes.ts` |
+| Sequence-annotation type system | `src/utils/macromolecule/annotations.ts` |
 | Amino acid palettes & names | `src/aminoacids.ts` |
 | Nucleotide palettes & names | `src/nucleotides.ts` |
 | Non-standard monomer palettes | `src/unknown.ts` |
@@ -284,6 +294,11 @@ Macromolecule grid cell rendering uses a layered async architecture:
 | Sequence scoring (identity/similarity) | `src/utils/macromolecule/scoring.ts` |
 | Natural monomer fingerprints | `src/utils/macromolecule/monomers.ts` |
 | MSA position scroller/header | `src/utils/sequence-position-scroller.ts` |
+| MSA annotation track | `src/utils/annotation-track.ts` |
+| Annotation cell-renderer overlay | `src/utils/cell-renderer-annotations.ts` |
+| Cross-package monomer highlight bus | `src/utils/macromolecule-highlight.ts` |
+| Monomer picker dialog | `src/utils/monomer-selection-dialog.ts` |
+| Sequence column input (`Macromolecule`-only) | `src/utils/sequence-column-input.ts` |
 | Substructure filter framework | `src/substructure-filter/bio-substructure-filter-types.ts` |
 | Nucleotide sequence library (fast) | `src/ntseq/ntseq.js` |
 | RDKit module accessor | `src/chem/rdkit-module.ts` |

package/package.json

@@ -8,7 +8,7 @@
     "access": "public"
   },
   "friendlyName": "Datagrok bio library",
-  "version": "5.65.1",
+  "version": "5.65.3",
   "description": "Bio utilities, types supporting Macromolecule, Molecule3D data",
   "dependencies": {
     "@datagrok-libraries/chem-meta": "^1.2.7",

package/src/monomer-works/to-atomic-level-utils.d.ts.map

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package/src/monomer-works/to-atomic-level-utils.js

@@ -384,37 +384,45 @@ function getResultingAtomBondCounts(monomerSeq, monomersDict, alphabet, polymerT
     }
     return { atomCount, bondCount, needsCapping };
 }
-// Triples-mode RNA assembly. Iterates by NUCLEOTIDE over the row's "core"
-// positions (those tagged SUGAR/BASE/PHOSPHATE), and emits at most one
-// TERMINAL_5P at the head and one TERMINAL_3P at the tail.
+// Role-driven RNA assembly. Walks the monomers in chain order and emits
+// each one according to its NucleotideRole (assigned by `buildRolesForHelmRna`
+// from the library, not from a fixed triple index):
+//   - BASE                                  → branch monomer, attached to the
+//                                             branch point of the sugar most
+//                                             recently emitted.
+//   - SUGAR / PHOSPHATE / TERMINAL_5P / 3P  → backbone monomer, chained to the
+//                                             previous backbone unit.
 //
-// Layout permutations the function handles:
-//   roles = [SUGAR, BASE, PHOSPHATE, ...]                     // standard RNA
-//   roles = [..., SUGAR, BASE]                                // no trailing P
-//   roles = [TERMINAL_5P, SUGAR, BASE, PHOSPHATE, ...]        // 5' modifier
-//   roles = [..., SUGAR, BASE, TERMINAL_3P]                   // 3' modifier (replaces last P)
-//   roles = [TERMINAL_5P, ..., TERMINAL_3P]                   // both
-//
-// When a TERMINAL_3P is present the OH cap MUST be skipped (the last
-// monomer is the chain end, period); the caller takes responsibility for
-// needsCapping=false in `getResultingAtomBondCounts`.
+// Because the role comes from chemistry, this transparently handles every
+// backbone layout — standard [sugar, base, phosphate] triples, a 5'-leading
+// phosphate, several phosphates / linkers in a row, a linker dropped in the
+// middle of the chain, missing trailing phosphate, and 5'/3' terminal
+// modifiers — without any index arithmetic. The first backbone monomer
+// naturally has no incoming chain bond (v.backboneAttachNode starts at 0),
+// and the trailing OH cap is added by the caller via needsCapping (skipped
+// when a TERMINAL_3P ends the chain).
 function runTriplesAssembly(monomerSeq, roles, monomersDict, molfileAtomBlock, molfileBondBlock, v, LC, monomers, steabsCollection, addAtoms, getAtoms) {
-    const has5pTerm = roles.length > 0 && roles[0] === NucleotideRole.TERMINAL_5P;
-    const has3pTerm = roles.length > 0 && roles[roles.length - 1] === NucleotideRole.TERMINAL_3P;
-    const coreStart = has5pTerm ? 1 : 0;
-    const coreEnd = has3pTerm ? roles.length - 1 : roles.length;
-    const coreLen = coreEnd - coreStart;
-    const N = Math.ceil(coreLen / 3); // nucleotide count in the core
-    // coreLen === 3N → trailing P present.  coreLen === 3N - 1 → no trailing P.
-    const hasTrailingP = coreLen === 3 * N;
-    // Helper: emit one monomer as a backbone unit and record its atom/bond
-    // ranges in the per-row monomer map.
-    const emitBackbone = (sm, mapKey) => {
+    void LC; // assembly is driven by per-monomer roles, not by LC.seqLength
+    for (let i = 0; i < monomerSeq.length; ++i) {
+        const sm = monomerSeq[i];
+        if (sm.symbol === GAP_SYMBOL)
+            continue;
+        const role = roles[i];
         const mG = getMolGraph(monomersDict, { symbol: sm.symbol, polymerType: helmTypeToPolymerType(sm.biotype) });
         const aFirst = v.nodeShift;
         const bFirst = v.bondShift;
-        addBackboneMonomerToMolblock(mG, molfileAtomBlock, molfileBondBlock, v);
-        mG.stereoAtoms?.forEach((i) => steabsCollection.push(i + getAtoms()));
+        v.i = i; // keep loop counter monotone (unused by nucleotide geometry)
+        if (role === NucleotideRole.BASE)
+            // Branch: attaches to v.branchAttachNode, set when the preceding sugar
+            // was emitted. Does not advance the backbone, so the next backbone unit
+            // still chains from that sugar's 3' side.
+            addBranchMonomerToMolblock(mG, molfileAtomBlock, molfileBondBlock, v);
+        else
+            // Backbone: sugar / phosphate / linker / terminal modifier. Chains from
+            // the previous backbone unit (none for the very first one) and, for a
+            // sugar, sets up the branch attach point for the next base.
+            addBackboneMonomerToMolblock(mG, molfileAtomBlock, molfileBondBlock, v);
+        mG.stereoAtoms?.forEach((s) => steabsCollection.push(s + getAtoms()));
         addAtoms(mG.atoms.x.length);
         const aList = [];
         for (let a = aFirst; a < v.nodeShift; ++a)
@@ -422,70 +430,7 @@ function runTriplesAssembly(monomerSeq, roles, monomersDict, molfileAtomBlock, m
         const bList = [];
         for (let b = bFirst; b < v.bondShift; ++b)
             bList.push(b);
-        monomers.set(mapKey, { biotype: sm.biotype, symbol: sm.symbol, atoms: aList, bonds: bList });
-    };
-    // 1. 5'-end terminal modifier (e.g. Chol).
-    if (has5pTerm) {
-        v.i = 0;
-        emitBackbone(monomerSeq[0], 0);
-    }
-    // 2. Core triples loop: each iteration emits [prev-P (if n>=1)] + sugar + base.
-    for (let n = 0; n < N; ++n) {
-        v.i = n + (has5pTerm ? 1 : 0); // keep v.i monotone across emits
-        const sugarSeqIdx = coreStart + 3 * n;
-        const baseSeqIdx = sugarSeqIdx + 1;
-        const sugarSm = monomerSeq[sugarSeqIdx];
-        const baseSm = monomerSeq[baseSeqIdx];
-        const sugarG = getMolGraph(monomersDict, { symbol: sugarSm.symbol, polymerType: helmTypeToPolymerType(sugarSm.biotype) });
-        const baseG = getMolGraph(monomersDict, { symbol: baseSm.symbol, polymerType: helmTypeToPolymerType(baseSm.biotype) });
-        // Inter-nucleotide phosphate sits at coreStart + 3*(n-1) + 2 for n >= 1.
-        if (n >= 1) {
-            const prevPhosKey = coreStart + 3 * (n - 1) + 2;
-            emitBackbone(monomerSeq[prevPhosKey], prevPhosKey);
-        }
-        // Sugar (backbone)
-        const sugarAtomFirst = v.nodeShift;
-        const sugarBondFirst = v.bondShift;
-        addBackboneMonomerToMolblock(sugarG, molfileAtomBlock, molfileBondBlock, v);
-        sugarG.stereoAtoms?.forEach((i) => steabsCollection.push(i + getAtoms()));
-        addAtoms(sugarG.atoms.x.length);
-        const sAList = [];
-        for (let a = sugarAtomFirst; a < v.nodeShift; ++a)
-            sAList.push(a);
-        const sBList = [];
-        for (let b = sugarBondFirst; b < v.bondShift; ++b)
-            sBList.push(b);
-        monomers.set(sugarSeqIdx, {
-            biotype: sugarSm.biotype, symbol: sugarSm.symbol,
-            atoms: sAList, bonds: sBList,
-        });
-        // Base (branch)
-        const baseAtomFirst = v.nodeShift;
-        const baseBondFirst = v.bondShift;
-        addBranchMonomerToMolblock(baseG, molfileAtomBlock, molfileBondBlock, v);
-        baseG.stereoAtoms?.forEach((i) => steabsCollection.push(i + getAtoms()));
-        addAtoms(baseG.atoms.x.length);
-        const bAList = [];
-        for (let a = baseAtomFirst; a < v.nodeShift; ++a)
-            bAList.push(a);
-        const bBList = [];
-        for (let b = baseBondFirst; b < v.bondShift; ++b)
-            bBList.push(b);
-        monomers.set(baseSeqIdx, {
-            biotype: baseSm.biotype, symbol: baseSm.symbol,
-            atoms: bAList, bonds: bBList,
-        });
-    }
-    // 3. Trailing phosphate (the LAST nucleotide's P) — only if HELM wrote
-    // one AND there is no 3'-terminal modifier replacing it.
-    if (hasTrailingP) {
-        const lastPhosKey = coreStart + 3 * (N - 1) + 2;
-        emitBackbone(monomerSeq[lastPhosKey], lastPhosKey);
-    }
-    // 4. 3'-end terminal modifier (e.g. GalNAc).
-    if (has3pTerm) {
-        v.i = N + (has5pTerm ? 1 : 0);
-        emitBackbone(monomerSeq[roles.length - 1], roles.length - 1);
+        monomers.set(i, { biotype: sm.biotype, symbol: sm.symbol, atoms: aList, bonds: bList });
     }
 }
 /** Keep precision upon floating point operations over atom coordinates

package/src/monomer-works/to-atomic-level-utils.js.map

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package/src/monomer-works/to-atomic-level.d.ts.map

@@ -1 +1 @@
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package/src/monomer-works/to-atomic-level.js

@@ -125,48 +125,65 @@ function pickRnaAlphabetFromHelm(seqCol, seqHelper) {
     for (let rowI = 0; rowI < seqCol.length; ++rowI) {
         const seqSS = sh.getSplitted(rowI);
         for (let i = 0; i < seqSS.length; ++i) {
-            // Sugars sit at index i % 3 === 0 in the HELM RNA triples layout.
-            if (i % 3 !== 0)
-                continue;
-            const sym = seqSS.getCanonical(i);
-            if (sym === C.DEOXYRIBOSE.symbol)
+            // Any deoxyribose sugar anywhere in the column → DNA. Don't rely on a
+            // fixed triple index (i % 3 === 0): a leading phosphate, repeated
+            // phosphates, or mid-chain linkers shift every monomer position, so the
+            // sugar is no longer guaranteed to sit at index 0 modulo 3.
+            if (seqSS.getCanonical(i) === C.DEOXYRIBOSE.symbol)
                 return ALPHABET.DNA;
         }
     }
     return ALPHABET.RNA;
 }
-// Returns 'r1-only' if the lib monomer has a single R-group labeled R1
-// (i.e. a 3'-end terminal modifier like GalNAc), 'r2-only' if it has only
-// R2 (a 5'-end terminal modifier like Chol), and null otherwise.
+// Classify a HELM RNA monomer by its library properties (monomer type +
+// R-groups), NOT by its position in the sequence:
+//   - Branch monomers (A/C/G/U/T and modified bases) → BASE. They carry a
+//     single R1 that attaches to the preceding sugar's R3 branch point.
+//   - Backbone monomers carrying a branch R-group (R3) → SUGAR (ribose,
+//     deoxyribose, and modified sugars such as fl2r / lna / m all expose
+//     R1/R2/R3).
+//   - Backbone monomers with two chain-extending R-groups and no branch →
+//     PHOSPHATE / linker (p, sp, Rsp, …). This is what makes a leading
+//     phosphate, several phosphates in a row, or a linker in the middle of
+//     the chain just work: each is recognised as a chain-extending unit,
+//     never mistaken for a sugar.
+//   - Single-R-group non-Branch monomers (Chol / GalNAc / Bio, which the
+//     library marks monomerType='Undefined') → 'terminal' chain-end
+//     modifiers. The caller decides 5' vs 3' from the boundary.
+//   - Unknown symbol (absent from lib) → null.
 //
-// IMPORTANT: nucleobases (A/C/G/U/T and their modified forms) are
-// monomerType='Branch' with a single R1, but they are NOT terminal
-// modifiers — they're branch attachments to the sugar's R3. We exclude
-// Branch monomers explicitly so the splitter's i-th-base position keeps
-// its BASE role.
-function classifyTerminal(monomerLib, polymerType, symbol) {
+// Returning roles from chemistry instead of index removes the rigid
+// "[sugar, base, phosphate] repeated" assumption that produced NaN
+// coordinates whenever a phosphate did not sit where the triple index
+// expected it.
+function classifyRnaRole(monomerLib, polymerType, symbol) {
     const m = monomerLib.getMonomer(polymerType, symbol);
-    if (!m || !m.rgroups || m.rgroups.length !== 1)
+    if (!m)
         return null;
     if (m["monomerType" /* HELM_FIELDS.MONOMER_TYPE */] === "Branch" /* HELM_MONOMER_TYPE.BRANCH */)
-        return null;
-    const lbl = m.rgroups[0].label;
-    if (lbl === 'R1')
-        return 'r1-only';
-    if (lbl === 'R2')
-        return 'r2-only';
-    return null;
+        return NucleotideRole.BASE;
+    const rgroups = m.rgroups ?? [];
+    // A chain-end modifier exposes exactly one attachment point.
+    if (rgroups.length <= 1)
+        return 'terminal';
+    // A sugar exposes a branch attachment (R3) for the nucleobase; a
+    // phosphate / linker only has chain-extending R-groups.
+    const hasBranchR = rgroups.some((rg) => rg.label === 'R3') || rgroups.length >= 3;
+    return hasBranchR ? NucleotideRole.SUGAR : NucleotideRole.PHOSPHATE;
 }
-// For HELM RNA rows, the splitter emits sugar/base/phosphate triples in
-// that fixed order (per `RNA_HELM_TRIPLET_MONOMER_REG`). Tag each entry
-// with its role from its index, then promote first / last entries to
-// TERMINAL_5P / TERMINAL_3P when the lib says they are single-R-group
-// terminal modifiers (Chol / GalNAc-style monomers).
+// Assign a NucleotideRole to every monomer of every HELM RNA row by
+// classifying each monomer from the library (see `classifyRnaRole`), then
+// resolving single-R-group terminal modifiers to TERMINAL_5P / TERMINAL_3P
+// based on the boundary they sit at.
+//
+// This is intentionally position-agnostic for the backbone: sugars, bases
+// and phosphates are tagged by what they ARE, so an arbitrary number of
+// phosphates / linkers may appear at the 5' end, between nucleotides, or
+// anywhere else, and still be assembled as a connected chain.
 //
-// Validation: after stripping the terminal positions the remaining "core"
-// length must be 0, 3K, or 3K+2 (the no-trailing-P variant). Rows that
-// don't fit fall back to bases-only mode by returning undefined for that
-// row.
+// A row falls back to bases-only mode (undefined) only when it cannot be
+// laid out as a linear chain: an unknown monomer, or a single-R-group
+// terminal modifier appearing mid-chain (it has nothing to extend to).
 function buildRolesForHelmRna(monomerSequencesArray, monomerLib, polymerType) {
     const out = new Array(monomerSequencesArray.length);
     for (let rowI = 0; rowI < monomerSequencesArray.length; ++rowI) {
@@ -175,38 +192,40 @@ function buildRolesForHelmRna(monomerSequencesArray, monomerLib, polymerType) {
             out[rowI] = undefined;
             continue;
         }
-        // Detect terminals at row boundaries. Conventionally the start would
-        // require r2-only (Chol-style) and the end would require r1-only
-        // (GalNAc/Bio-style), but HELM authors sometimes put the "wrong" one
-        // at either end. We accept ANY single-R-group non-Branch monomer at
-        // each boundary; getMolGraph then swaps the rNodes so the real R
-        // ends up where the role expects it.
-        const startTerm = row.length >= 1 &&
-            classifyTerminal(monomerLib, polymerType, row[0].symbol) !== null;
-        // Don't double-count when row.length === 1 and the single monomer
-        // already became a 5'-terminal: it doesn't ALSO get treated as a 3'.
-        const endTerm = row.length >= 1 && !(startTerm && row.length === 1) &&
-            classifyTerminal(monomerLib, polymerType, row[row.length - 1].symbol) !== null;
-        const coreLen = row.length - (startTerm ? 1 : 0) - (endTerm ? 1 : 0);
-        if (coreLen < 0 || !(coreLen % 3 === 0 || coreLen % 3 === 2)) {
+        const classes = new Array(row.length);
+        let classifiable = true;
+        for (let i = 0; i < row.length; ++i) {
+            classes[i] = classifyRnaRole(monomerLib, polymerType, row[i].symbol);
+            if (classes[i] === null) {
+                classifiable = false;
+                break;
+            }
+        }
+        if (!classifiable) {
             out[rowI] = undefined;
             continue;
         }
         const roles = new Array(row.length);
-        let coreI = 0;
+        let fellBack = false;
         for (let i = 0; i < row.length; ++i) {
-            if (i === 0 && startTerm) {
-                roles[i] = NucleotideRole.TERMINAL_5P;
-                continue;
-            }
-            if (i === row.length - 1 && endTerm) {
-                roles[i] = NucleotideRole.TERMINAL_3P;
-                continue;
+            if (classes[i] === 'terminal') {
+                // A single-R-group modifier can only cap a chain end. HELM authors
+                // sometimes put the "wrong" one at either boundary (e.g. GalNAc with
+                // only R1 at the 5' end); getMolGraph swaps the rNodes so the real
+                // R lands where the role expects it.
+                if (i === 0)
+                    roles[i] = NucleotideRole.TERMINAL_5P;
+                else if (i === row.length - 1)
+                    roles[i] = NucleotideRole.TERMINAL_3P;
+                else {
+                    fellBack = true;
+                    break;
+                }
             }
-            roles[i] = (coreI % 3);
-            coreI++;
+            else
+                roles[i] = classes[i];
         }
-        out[rowI] = roles;
+        out[rowI] = fellBack ? undefined : roles;
     }
     return out;
 }

package/src/monomer-works/to-atomic-level.js.map

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package/src/utils/cell-renderer-async-base.d.ts.map

@@ -1 +1 @@
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package/src/utils/cell-renderer-async-base.js

@@ -256,6 +256,7 @@ export class CellRendererBackAsyncBase extends CellRendererBackBase {
     render(g, x, y, w, h, gridCell, cellStyle) {
         if (gridCell.tableRowIndex == null)
             return;
+        this.cleanColVersion = this.tableCol ? this.tableCol.version : -1;
         const service = this.getRenderService();
         if (!service)
             return;

package/src/utils/cell-renderer-async-base.js.map

@@ -1 +1 @@
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package/src/utils/cell-renderer-back-base.d.ts

@@ -26,6 +26,7 @@ export declare abstract class CellRendererBackBase<TValue> extends CellRendererB
     protected subs: Unsubscribable[];
     protected dirty: boolean;
     protected destroyed: boolean;
+    protected cleanColVersion: number;
     /** Overriding care to trigger {@link onRendered} event. */
     protected constructor(
     /** Not null if rendered on a grid */

package/src/utils/cell-renderer-back-base.d.ts.map

@@ -1 +1 @@
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+{"version":3,"file":"cell-renderer-back-base.d.ts","sourceRoot":"","sources":["cell-renderer-back-base.ts"],"names":[],"mappings":"AACA,OAAO,KAAK,EAAE,MAAM,iBAAiB,CAAC;AAGtC,OAAO,EAAC,UAAU,EAAE,OAAO,EAAE,cAAc,EAAC,MAAM,MAAM,CAAC;AAIzD,OAAO,EAAC,OAAO,EAAC,MAAM,UAAU,CAAC;AACjC,OAAO,EAAC,SAAS,EAAC,MAAM,mBAAmB,CAAC;AAE5C,MAAM,MAAM,oBAAoB,CAAC,KAAK,IAAI;IACxC,YAAY,EAAE,KAAK,CAAC;CACrB,CAAA;AAED,wBAAgB,kBAAkB,CAAC,MAAM,EAAE,KAAK,SAAS,oBAAoB,CAAC,MAAM,CAAC,EACnF,QAAQ,EAAE,EAAE,CAAC,QAAQ,GACpB,CAAC,EAAE,CAAC,UAAU,GAAG,IAAI,EAAE,EAAE,CAAC,MAAM,CAAC,MAAM,CAAC,EAAE,oBAAoB,CAAC,KAAK,CAAC,CAAC,CAcxE;AAGD,8BAAsB,oBAAoB;IACxC,QAAQ,CAAC,MAAM,CAAC,CAAC,EAAE,wBAAwB,EAAE,CAAC,EAAE,MAAM,EAAE,CAAC,EAAE,MAAM,EAAE,CAAC,EAAE,MAAM,EAAE,CAAC,EAAE,MAAM,EACrF,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,SAAS,EAAE,EAAE,CAAC,aAAa,GAAG,IAAI;IAC3D,SAAS,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,aAAa,GAAG,IAAI;IACxD,UAAU,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,aAAa,GAAG,IAAI;IACzD,YAAY,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACxD,YAAY,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACxD,WAAW,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACvD,SAAS,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACrD,WAAW,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACvD,OAAO,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;IACnD,aAAa,CAAC,QAAQ,EAAE,EAAE,CAAC,QAAQ,EAAE,CAAC,EAAE,UAAU,GAAG,IAAI;CAC1D;AAGD,8BAAsB,oBAAoB,CAAC,MAAM,CAAE,SAAQ,oBAAqB,YAAW,SAAS;IAQhG,qCAAqC;IACrC,SAAS,CAAC,QAAQ,CAAC,OAAO,EAAE,EAAE,CAAC,UAAU,GAAG,IAAI;IAChD,SAAS,CAAC,QAAQ,CAAC,QAAQ,EAAE,EAAE,CAAC,MAAM,CAAC,MAAM,CAAC;aAC9B,MAAM,EAAE,OAAO;IAVjC,SAAS,CAAC,IAAI,EAAE,cAAc,EAAE,CAAM;IACtC,SAAS,CAAC,KAAK,EAAE,OAAO,CAAQ;IAChC,SAAS,CAAC,SAAS,EAAE,OAAO,CAAS;IACrC,SAAS,CAAC,eAAe,EAAE,MAAM,CAAM;IAEvC,2DAA2D;IAC3D,SAAS;IACP,qCAAqC;IAClB,OAAO,EAAE,EAAE,CAAC,UAAU,GAAG,IAAI,EAC7B,QAAQ,EAAE,EAAE,CAAC,MAAM,CAAC,MAAM,CAAC,EAC9B,MAAM,EAAE,OAAO;IA6CjC,OAAO,CAAC,MAAM,CAAC,aAAa,CAAc;IAC1C,SAAS,CAAC,QAAQ,CAAC,QAAQ,EAAE,MAAM,CAAwC;IAE3E,SAAS,CAAC,KAAK,IAAI,MAAM;IAIzB,SAAS,CAAC,OAAO,IAAI,IAAI;IAMzB,SAAS,CAAC,cAAc,IAAI,IAAI;IAIhC,SAAS,CAAC,KAAK,IAAI,IAAI;IAMhB,MAAM,EAAE,KAAK,EAAE,CAAM;IAE5B,SAAS,CAAC,WAAW,EAAE,OAAO,CAAC,IAAI,CAAC,CAAuB;IAE3D,IAAI,UAAU,IAAI,UAAU,CAAC,IAAI,CAAC,CAA6B;IAE/D,UAAU,CAAC,MAAM,CAAC,EAAE,MAAM,GAAG,IAAI;IAI3B,aAAa,CACjB,OAAO,GAAE,MAAc,EAAE,MAAM,GAAE,MAA6B,GAC7D,OAAO,CAAC,IAAI,CAAC;CAejB"}

package/src/utils/cell-renderer-back-base.js

@@ -42,13 +42,18 @@ export class CellRendererBackBase extends CellRendererBackStub {
         this.subs = [];
         this.dirty = true;
         this.destroyed = false;
+        this.cleanColVersion = -1;
         this.viewerId = ++CellRendererBackBase.viewerCounter;
         // -- IRenderer --
         this.errors = [];
         this._onRendered = new Subject();
         if (this.tableCol && this.tableCol.dataFrame) {
+            this.cleanColVersion = this.tableCol.version;
             this.subs.push(this.tableCol.dataFrame.onDataChanged.subscribe(() => {
-                this.dirty = true;
+                if (this.tableCol?.version !== this.cleanColVersion) {
+                    this.cleanColVersion = this.tableCol?.version;
+                    this.dirty = true;
+                }
             }));
             this.subs.push(this.tableCol.dataFrame.onColumnsRemoved.subscribe((_) => {
                 try {

package/src/utils/cell-renderer-back-base.js.map

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