boltz-api 0.42.0 → 0.43.0

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Files changed (22) hide show
  1. package/CHANGELOG.md +8 -0
  2. package/package.json +1 -1
  3. package/resources/predictions/structure-and-binding.d.mts +12 -24
  4. package/resources/predictions/structure-and-binding.d.mts.map +1 -1
  5. package/resources/predictions/structure-and-binding.d.ts +12 -24
  6. package/resources/predictions/structure-and-binding.d.ts.map +1 -1
  7. package/resources/small-molecule/design.d.mts +0 -80
  8. package/resources/small-molecule/design.d.mts.map +1 -1
  9. package/resources/small-molecule/design.d.ts +0 -80
  10. package/resources/small-molecule/design.d.ts.map +1 -1
  11. package/resources/small-molecule/library-screen.d.mts +0 -80
  12. package/resources/small-molecule/library-screen.d.mts.map +1 -1
  13. package/resources/small-molecule/library-screen.d.ts +0 -80
  14. package/resources/small-molecule/library-screen.d.ts.map +1 -1
  15. package/src/resources/predictions/structure-and-binding.ts +12 -28
  16. package/src/resources/small-molecule/design.ts +0 -100
  17. package/src/resources/small-molecule/library-screen.ts +0 -100
  18. package/src/version.ts +1 -1
  19. package/version.d.mts +1 -1
  20. package/version.d.ts +1 -1
  21. package/version.js +1 -1
  22. package/version.mjs +1 -1
package/CHANGELOG.md CHANGED
@@ -1,5 +1,13 @@
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  # Changelog
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+ ## 0.43.0 (2026-06-09)
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+
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+ Full Changelog: [v0.42.0...v0.43.0](https://github.com/boltz-bio/boltz-api-typescript/compare/v0.42.0...v0.43.0)
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+
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+ ### Features
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+
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+ * **compute:** accept legacy Boltz template inputs ([9a83a88](https://github.com/boltz-bio/boltz-api-typescript/commit/9a83a88e808758a164b5934e3715277698c4a4dd))
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+
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  ## 0.42.0 (2026-06-09)
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  Full Changelog: [v0.41.0...v0.42.0](https://github.com/boltz-bio/boltz-api-typescript/compare/v0.41.0...v0.42.0)
package/package.json CHANGED
@@ -1,6 +1,6 @@
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  {
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  "name": "boltz-api",
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- "version": "0.42.0",
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+ "version": "0.43.0",
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  "description": "The official TypeScript library for the Boltz API",
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  "author": "Boltz <contact@boltz.bio>",
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  "types": "./index.d.ts",
package/resources/predictions/structure-and-binding.d.mts CHANGED
@@ -613,13 +613,10 @@ export declare namespace StructureAndBindingRetrieveResponse {
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  template_chains: Array<Template.TemplateChain>;
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  template_structure: Template.TemplateStructure;
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  /**
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- * Force the template alignment within threshold.
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+ * Force the template reference potential with this distance threshold in
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+ * angstroms. Omit to use the template without force.
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  */
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- force?: boolean;
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- /**
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- * Distance threshold in angstroms used when force is true.
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- */
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- threshold?: number;
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+ force_threshold_angstroms?: number;
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  }
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  namespace Template {
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  /**
@@ -1426,13 +1423,10 @@ export declare namespace StructureAndBindingStartResponse {
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  template_chains: Array<Template.TemplateChain>;
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  template_structure: Template.TemplateStructure;
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  /**
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- * Force the template alignment within threshold.
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- */
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- force?: boolean;
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- /**
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- * Distance threshold in angstroms used when force is true.
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+ * Force the template reference potential with this distance threshold in
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+ * angstroms. Omit to use the template without force.
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  */
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- threshold?: number;
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+ force_threshold_angstroms?: number;
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  }
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  namespace Template {
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  /**
@@ -2102,13 +2096,10 @@ export declare namespace StructureAndBindingEstimateCostParams {
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  */
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  template_structure: Template.URLSource | Template.TemplateStructureBase64Source;
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  /**
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- * Force the template alignment within threshold.
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+ * Force the template reference potential with this distance threshold in
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+ * angstroms. Omit to use the template without force.
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  */
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- force?: boolean;
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- /**
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- * Distance threshold in angstroms used when force is true.
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- */
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- threshold?: number;
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+ force_threshold_angstroms?: number;
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  }
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  namespace Template {
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  /**
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  */
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  template_structure: Template.URLSource | Template.TemplateStructureBase64Source;
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  /**
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- * Force the template alignment within threshold.
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- */
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- force?: boolean;
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- /**
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- * Distance threshold in angstroms used when force is true.
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+ * Force the template reference potential with this distance threshold in
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+ * angstroms. Omit to use the template without force.
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  */
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- threshold?: number;
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+ force_threshold_angstroms?: number;
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  }
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  namespace Template {
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  /**
package/resources/predictions/structure-and-binding.d.mts.map CHANGED
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package/resources/predictions/structure-and-binding.d.ts CHANGED
@@ -613,13 +613,10 @@ export declare namespace StructureAndBindingRetrieveResponse {
613
613
  template_chains: Array<Template.TemplateChain>;
614
614
  template_structure: Template.TemplateStructure;
615
615
  /**
616
- * Force the template alignment within threshold.
616
+ * Force the template reference potential with this distance threshold in
617
+ * angstroms. Omit to use the template without force.
617
618
  */
618
- force?: boolean;
619
- /**
620
- * Distance threshold in angstroms used when force is true.
621
- */
622
- threshold?: number;
619
+ force_threshold_angstroms?: number;
623
620
  }
624
621
  namespace Template {
625
622
  /**
@@ -1426,13 +1423,10 @@ export declare namespace StructureAndBindingStartResponse {
1426
1423
  template_chains: Array<Template.TemplateChain>;
1427
1424
  template_structure: Template.TemplateStructure;
1428
1425
  /**
1429
- * Force the template alignment within threshold.
1430
- */
1431
- force?: boolean;
1432
- /**
1433
- * Distance threshold in angstroms used when force is true.
1426
+ * Force the template reference potential with this distance threshold in
1427
+ * angstroms. Omit to use the template without force.
1434
1428
  */
1435
- threshold?: number;
1429
+ force_threshold_angstroms?: number;
1436
1430
  }
1437
1431
  namespace Template {
1438
1432
  /**
@@ -2102,13 +2096,10 @@ export declare namespace StructureAndBindingEstimateCostParams {
2102
2096
  */
2103
2097
  template_structure: Template.URLSource | Template.TemplateStructureBase64Source;
2104
2098
  /**
2105
- * Force the template alignment within threshold.
2099
+ * Force the template reference potential with this distance threshold in
2100
+ * angstroms. Omit to use the template without force.
2106
2101
  */
2107
- force?: boolean;
2108
- /**
2109
- * Distance threshold in angstroms used when force is true.
2110
- */
2111
- threshold?: number;
2102
+ force_threshold_angstroms?: number;
2112
2103
  }
2113
2104
  namespace Template {
2114
2105
  /**
@@ -2620,13 +2611,10 @@ export declare namespace StructureAndBindingStartParams {
2620
2611
  */
2621
2612
  template_structure: Template.URLSource | Template.TemplateStructureBase64Source;
2622
2613
  /**
2623
- * Force the template alignment within threshold.
2624
- */
2625
- force?: boolean;
2626
- /**
2627
- * Distance threshold in angstroms used when force is true.
2614
+ * Force the template reference potential with this distance threshold in
2615
+ * angstroms. Omit to use the template without force.
2628
2616
  */
2629
- threshold?: number;
2617
+ force_threshold_angstroms?: number;
2630
2618
  }
2631
2619
  namespace Template {
2632
2620
  /**
package/resources/predictions/structure-and-binding.d.ts.map CHANGED
@@ -1 +1 @@
1
- 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package/resources/small-molecule/design.d.mts CHANGED
@@ -236,12 +236,6 @@ export declare namespace DesignRetrieveResponse {
236
236
  pocket_residues?: {
237
237
  [key: string]: Array<number>;
238
238
  };
239
- /**
240
- * Precomputed affinity-pocket artifacts for this target. When provided,
241
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
242
- * affinity pocket search.
243
- */
244
- precomputed_affinity_pocket?: Target.PrecomputedAffinityPocket;
245
239
  /**
246
240
  * Reference ligands as SMILES strings that help the model identify the binding
247
241
  * pocket. When omitted, a set of drug-like default ligands is used for pocket
@@ -484,16 +478,6 @@ export declare namespace DesignRetrieveResponse {
484
478
  type: 'ligand_contact';
485
479
  }
486
480
  }
487
- /**
488
- * Precomputed affinity-pocket artifacts for this target. When provided,
489
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
490
- * affinity pocket search.
491
- */
492
- interface PrecomputedAffinityPocket {
493
- method: 'reference_ligands' | 'residue_ids';
494
- pocket_file_url: string;
495
- structure_file_url: string;
496
- }
497
481
  }
498
482
  /**
499
483
  * Molecule filtering configuration. Controls both Boltz built-in SMARTS filtering
@@ -1137,12 +1121,6 @@ export declare namespace DesignStartResponse {
1137
1121
  pocket_residues?: {
1138
1122
  [key: string]: Array<number>;
1139
1123
  };
1140
- /**
1141
- * Precomputed affinity-pocket artifacts for this target. When provided,
1142
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
1143
- * affinity pocket search.
1144
- */
1145
- precomputed_affinity_pocket?: Target.PrecomputedAffinityPocket;
1146
1124
  /**
1147
1125
  * Reference ligands as SMILES strings that help the model identify the binding
1148
1126
  * pocket. When omitted, a set of drug-like default ligands is used for pocket
@@ -1385,16 +1363,6 @@ export declare namespace DesignStartResponse {
1385
1363
  type: 'ligand_contact';
1386
1364
  }
1387
1365
  }
1388
- /**
1389
- * Precomputed affinity-pocket artifacts for this target. When provided,
1390
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
1391
- * affinity pocket search.
1392
- */
1393
- interface PrecomputedAffinityPocket {
1394
- method: 'reference_ligands' | 'residue_ids';
1395
- pocket_file_url: string;
1396
- structure_file_url: string;
1397
- }
1398
1366
  }
1399
1367
  /**
1400
1368
  * Molecule filtering configuration. Controls both Boltz built-in SMARTS filtering
@@ -1799,12 +1767,6 @@ export declare namespace DesignStopResponse {
1799
1767
  pocket_residues?: {
1800
1768
  [key: string]: Array<number>;
1801
1769
  };
1802
- /**
1803
- * Precomputed affinity-pocket artifacts for this target. When provided,
1804
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
1805
- * affinity pocket search.
1806
- */
1807
- precomputed_affinity_pocket?: Target.PrecomputedAffinityPocket;
1808
1770
  /**
1809
1771
  * Reference ligands as SMILES strings that help the model identify the binding
1810
1772
  * pocket. When omitted, a set of drug-like default ligands is used for pocket
@@ -2047,16 +2009,6 @@ export declare namespace DesignStopResponse {
2047
2009
  type: 'ligand_contact';
2048
2010
  }
2049
2011
  }
2050
- /**
2051
- * Precomputed affinity-pocket artifacts for this target. When provided,
2052
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
2053
- * affinity pocket search.
2054
- */
2055
- interface PrecomputedAffinityPocket {
2056
- method: 'reference_ligands' | 'residue_ids';
2057
- pocket_file_url: string;
2058
- structure_file_url: string;
2059
- }
2060
2012
  }
2061
2013
  /**
2062
2014
  * Molecule filtering configuration. Controls both Boltz built-in SMARTS filtering
@@ -2413,12 +2365,6 @@ export declare namespace DesignEstimateCostParams {
2413
2365
  pocket_residues?: {
2414
2366
  [key: string]: Array<number>;
2415
2367
  };
2416
- /**
2417
- * Precomputed affinity-pocket artifacts for this target. When provided,
2418
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
2419
- * affinity pocket search.
2420
- */
2421
- precomputed_affinity_pocket?: Target.PrecomputedAffinityPocket;
2422
2368
  /**
2423
2369
  * Reference ligands as SMILES strings that help the model identify the binding
2424
2370
  * pocket. When omitted, a set of drug-like default ligands is used for pocket
@@ -2661,16 +2607,6 @@ export declare namespace DesignEstimateCostParams {
2661
2607
  type: 'ligand_contact';
2662
2608
  }
2663
2609
  }
2664
- /**
2665
- * Precomputed affinity-pocket artifacts for this target. When provided,
2666
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
2667
- * affinity pocket search.
2668
- */
2669
- interface PrecomputedAffinityPocket {
2670
- method: 'reference_ligands' | 'residue_ids';
2671
- pocket_file_url: string;
2672
- structure_file_url: string;
2673
- }
2674
2610
  }
2675
2611
  /**
2676
2612
  * Molecule filtering configuration. Controls both Boltz built-in SMARTS filtering
@@ -3004,12 +2940,6 @@ export declare namespace DesignStartParams {
3004
2940
  pocket_residues?: {
3005
2941
  [key: string]: Array<number>;
3006
2942
  };
3007
- /**
3008
- * Precomputed affinity-pocket artifacts for this target. When provided,
3009
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
3010
- * affinity pocket search.
3011
- */
3012
- precomputed_affinity_pocket?: Target.PrecomputedAffinityPocket;
3013
2943
  /**
3014
2944
  * Reference ligands as SMILES strings that help the model identify the binding
3015
2945
  * pocket. When omitted, a set of drug-like default ligands is used for pocket
@@ -3252,16 +3182,6 @@ export declare namespace DesignStartParams {
3252
3182
  type: 'ligand_contact';
3253
3183
  }
3254
3184
  }
3255
- /**
3256
- * Precomputed affinity-pocket artifacts for this target. When provided,
3257
- * small-molecule design/screen pipelines reuse this pocket and skip Compute
3258
- * affinity pocket search.
3259
- */
3260
- interface PrecomputedAffinityPocket {
3261
- method: 'reference_ligands' | 'residue_ids';
3262
- pocket_file_url: string;
3263
- structure_file_url: string;
3264
- }
3265
3185
  }
3266
3186
  /**
3267
3187
  * Molecule filtering configuration. Controls both Boltz built-in SMARTS filtering