boltz-api 0.37.1 → 0.39.0

package/CHANGELOG.md

@@ -1,5 +1,21 @@
 # Changelog
 
+## 0.39.0 (2026-05-27)
+
+Full Changelog: [v0.38.0...v0.39.0](https://github.com/boltz-bio/boltz-api-typescript/compare/v0.38.0...v0.39.0)
+
+### Features
+
+* [codex] Add custom MSA support to structure predictions ([ad27bf1](https://github.com/boltz-bio/boltz-api-typescript/commit/ad27bf1985e4845897b0b51e64a6b02a540a2201))
+
+## 0.38.0 (2026-05-26)
+
+Full Changelog: [v0.37.1...v0.38.0](https://github.com/boltz-bio/boltz-api-typescript/compare/v0.37.1...v0.38.0)
+
+### Features
+
+* Add Boltz2 templates to compute API ([62214af](https://github.com/boltz-bio/boltz-api-typescript/commit/62214afab573e1ed80ba00d77381d038e5fc234a))
+
 ## 0.37.1 (2026-05-26)
 
 Full Changelog: [v0.37.0...v0.37.1](https://github.com/boltz-bio/boltz-api-typescript/compare/v0.37.0...v0.37.1)

package/package.json

@@ -1,6 +1,6 @@
 {
   "name": "boltz-api",
-  "version": "0.37.1",
+  "version": "0.39.0",
   "description": "The official TypeScript library for the Boltz API",
   "author": "Boltz <contact@boltz.bio>",
   "types": "./index.d.ts",

package/resources/predictions/structure-and-binding.d.mts

@@ -169,7 +169,7 @@ export declare namespace StructureAndBindingRetrieveResponse {
          * Entities (proteins, RNA, DNA, ligands) forming the complex to predict. Order
          * determines chain assignment.
          */
-        entities: Array<Input.ProteinEntityResponse | Input.RnaEntityResponse | Input.DnaEntityResponse | Input.LigandCcdEntityResponse | Input.LigandSmilesEntityResponse>;
+        entities: Array<Input.Boltz2ProteinEntityResponse | Input.RnaEntityResponse | Input.DnaEntityResponse | Input.LigandCcdEntityResponse | Input.LigandSmilesEntityResponse>;
         binding?: Input.LigandProteinBindingResponse | Input.ProteinProteinBindingResponse;
         /**
          * Bond constraints between atoms. Atom-level ligand references currently support
@@ -186,9 +186,14 @@ export declare namespace StructureAndBindingRetrieveResponse {
          * Number of structure samples to generate
          */
         num_samples?: number;
+        /**
+         * Template structure files to guide protein-chain prediction. Supports up to 4 CIF
+         * or PDB templates from HTTPS URLs or base64 uploads.
+         */
+        templates?: Array<Input.Template>;
     }
     namespace Input {
-        interface ProteinEntityResponse {
+        interface Boltz2ProteinEntityResponse {
             /**
              * Chain IDs for this entity
              */
@@ -206,9 +211,14 @@ export declare namespace StructureAndBindingRetrieveResponse {
              * Post-translational modifications. Optional; defaults to an empty list when
              * omitted.
              */
-            modifications?: Array<ProteinEntityResponse.Modification>;
+            modifications?: Array<Boltz2ProteinEntityResponse.Modification>;
+            /**
+             * Optional protein MSA control. Omit to use automatic MSA generation; use custom
+             * for user-provided A3M/CSV; use empty for single-sequence mode.
+             */
+            msa?: Boltz2ProteinEntityResponse.Boltz2CustomMsaResponse | Boltz2ProteinEntityResponse.Boltz2EmptyMsaResponse;
         }
-        namespace ProteinEntityResponse {
+        namespace Boltz2ProteinEntityResponse {
             interface Modification {
                 /**
                  * 0-based index of the residue to modify
@@ -221,6 +231,35 @@ export declare namespace StructureAndBindingRetrieveResponse {
                  */
                 value: string;
             }
+            /**
+             * Custom MSA file to use for this protein entity.
+             */
+            interface Boltz2CustomMsaResponse {
+                /**
+                 * Custom MSA file format. Boltz supports A3M and CSV MSA files.
+                 */
+                format: 'a3m' | 'csv';
+                source: Boltz2CustomMsaResponse.Source;
+                type: 'custom';
+            }
+            namespace Boltz2CustomMsaResponse {
+                interface Source {
+                    /**
+                     * URL to download the file
+                     */
+                    url: string;
+                    /**
+                     * When the presigned URL expires
+                     */
+                    url_expires_at: string;
+                }
+            }
+            /**
+             * Run this protein entity in single-sequence mode without an MSA.
+             */
+            interface Boltz2EmptyMsaResponse {
+                type: 'empty';
+            }
         }
         interface RnaEntityResponse {
             /**
@@ -528,6 +567,41 @@ export declare namespace StructureAndBindingRetrieveResponse {
              */
             step_scale?: number;
         }
+        interface Template {
+            /**
+             * Template structure format. Base64 sources must use a matching media_type.
+             */
+            format: 'cif' | 'pdb';
+            source: Template.Source;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            chain_id?: string | Array<string>;
+            /**
+             * Force the template alignment within threshold.
+             */
+            force?: boolean;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            template_id?: string | Array<string>;
+            /**
+             * Distance threshold in angstroms used when force is true.
+             */
+            threshold?: number;
+        }
+        namespace Template {
+            interface Source {
+                /**
+                 * URL to download the file
+                 */
+                url: string;
+                /**
+                 * When the presigned URL expires
+                 */
+                url_expires_at: string;
+            }
+        }
     }
     /**
      * Prediction output when succeeded
@@ -866,7 +940,7 @@ export declare namespace StructureAndBindingStartResponse {
          * Entities (proteins, RNA, DNA, ligands) forming the complex to predict. Order
          * determines chain assignment.
          */
-        entities: Array<Input.ProteinEntityResponse | Input.RnaEntityResponse | Input.DnaEntityResponse | Input.LigandCcdEntityResponse | Input.LigandSmilesEntityResponse>;
+        entities: Array<Input.Boltz2ProteinEntityResponse | Input.RnaEntityResponse | Input.DnaEntityResponse | Input.LigandCcdEntityResponse | Input.LigandSmilesEntityResponse>;
         binding?: Input.LigandProteinBindingResponse | Input.ProteinProteinBindingResponse;
         /**
          * Bond constraints between atoms. Atom-level ligand references currently support
@@ -883,9 +957,14 @@ export declare namespace StructureAndBindingStartResponse {
          * Number of structure samples to generate
          */
         num_samples?: number;
+        /**
+         * Template structure files to guide protein-chain prediction. Supports up to 4 CIF
+         * or PDB templates from HTTPS URLs or base64 uploads.
+         */
+        templates?: Array<Input.Template>;
     }
     namespace Input {
-        interface ProteinEntityResponse {
+        interface Boltz2ProteinEntityResponse {
             /**
              * Chain IDs for this entity
              */
@@ -903,9 +982,14 @@ export declare namespace StructureAndBindingStartResponse {
              * Post-translational modifications. Optional; defaults to an empty list when
              * omitted.
              */
-            modifications?: Array<ProteinEntityResponse.Modification>;
+            modifications?: Array<Boltz2ProteinEntityResponse.Modification>;
+            /**
+             * Optional protein MSA control. Omit to use automatic MSA generation; use custom
+             * for user-provided A3M/CSV; use empty for single-sequence mode.
+             */
+            msa?: Boltz2ProteinEntityResponse.Boltz2CustomMsaResponse | Boltz2ProteinEntityResponse.Boltz2EmptyMsaResponse;
         }
-        namespace ProteinEntityResponse {
+        namespace Boltz2ProteinEntityResponse {
             interface Modification {
                 /**
                  * 0-based index of the residue to modify
@@ -918,6 +1002,35 @@ export declare namespace StructureAndBindingStartResponse {
                  */
                 value: string;
             }
+            /**
+             * Custom MSA file to use for this protein entity.
+             */
+            interface Boltz2CustomMsaResponse {
+                /**
+                 * Custom MSA file format. Boltz supports A3M and CSV MSA files.
+                 */
+                format: 'a3m' | 'csv';
+                source: Boltz2CustomMsaResponse.Source;
+                type: 'custom';
+            }
+            namespace Boltz2CustomMsaResponse {
+                interface Source {
+                    /**
+                     * URL to download the file
+                     */
+                    url: string;
+                    /**
+                     * When the presigned URL expires
+                     */
+                    url_expires_at: string;
+                }
+            }
+            /**
+             * Run this protein entity in single-sequence mode without an MSA.
+             */
+            interface Boltz2EmptyMsaResponse {
+                type: 'empty';
+            }
         }
         interface RnaEntityResponse {
             /**
@@ -1225,6 +1338,41 @@ export declare namespace StructureAndBindingStartResponse {
              */
             step_scale?: number;
         }
+        interface Template {
+            /**
+             * Template structure format. Base64 sources must use a matching media_type.
+             */
+            format: 'cif' | 'pdb';
+            source: Template.Source;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            chain_id?: string | Array<string>;
+            /**
+             * Force the template alignment within threshold.
+             */
+            force?: boolean;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            template_id?: string | Array<string>;
+            /**
+             * Distance threshold in angstroms used when force is true.
+             */
+            threshold?: number;
+        }
+        namespace Template {
+            interface Source {
+                /**
+                 * URL to download the file
+                 */
+                url: string;
+                /**
+                 * When the presigned URL expires
+                 */
+                url_expires_at: string;
+            }
+        }
     }
     /**
      * Prediction output when succeeded
@@ -1414,7 +1562,7 @@ export declare namespace StructureAndBindingEstimateCostParams {
          * Entities (proteins, RNA, DNA, ligands) forming the complex to predict. Order
          * determines chain assignment.
          */
-        entities: Array<Input.ProteinEntity | Input.RnaEntity | Input.DnaEntity | Input.LigandCcdEntity | Input.LigandSmilesEntity>;
+        entities: Array<Input.Boltz2ProteinEntity | Input.RnaEntity | Input.DnaEntity | Input.LigandCcdEntity | Input.LigandSmilesEntity>;
         binding?: Input.LigandProteinBinding | Input.ProteinProteinBinding;
         /**
          * Bond constraints between atoms. Atom-level ligand references currently support
@@ -1431,9 +1579,14 @@ export declare namespace StructureAndBindingEstimateCostParams {
          * Number of structure samples to generate
          */
         num_samples?: number;
+        /**
+         * Template structure files to guide protein-chain prediction. Supports up to 4 CIF
+         * or PDB templates from HTTPS URLs or base64 uploads.
+         */
+        templates?: Array<Input.Template>;
     }
     namespace Input {
-        interface ProteinEntity {
+        interface Boltz2ProteinEntity {
             /**
              * Chain IDs for this entity
              */
@@ -1451,9 +1604,14 @@ export declare namespace StructureAndBindingEstimateCostParams {
              * Post-translational modifications. Optional; defaults to an empty list when
              * omitted.
              */
-            modifications?: Array<ProteinEntity.Modification>;
+            modifications?: Array<Boltz2ProteinEntity.Modification>;
+            /**
+             * Optional protein MSA control. Omit to use automatic MSA generation; use custom
+             * for user-provided A3M/CSV; use empty for single-sequence mode.
+             */
+            msa?: Boltz2ProteinEntity.Boltz2CustomMsa | Boltz2ProteinEntity.Boltz2EmptyMsa;
         }
-        namespace ProteinEntity {
+        namespace Boltz2ProteinEntity {
             interface Modification {
                 /**
                  * 0-based index of the residue to modify
@@ -1466,6 +1624,43 @@ export declare namespace StructureAndBindingEstimateCostParams {
                  */
                 value: string;
             }
+            /**
+             * Custom MSA file to use for this protein entity.
+             */
+            interface Boltz2CustomMsa {
+                /**
+                 * Custom MSA file format. Boltz supports A3M and CSV MSA files.
+                 */
+                format: 'a3m' | 'csv';
+                /**
+                 * How to provide a file to the API
+                 */
+                source: Boltz2CustomMsa.URLSource | Boltz2CustomMsa.Base64Source;
+                type: 'custom';
+            }
+            namespace Boltz2CustomMsa {
+                interface URLSource {
+                    type: 'url';
+                    url: string;
+                }
+                interface Base64Source {
+                    /**
+                     * Base64-encoded file contents
+                     */
+                    data: string;
+                    /**
+                     * MIME type (e.g., text/csv)
+                     */
+                    media_type: string;
+                    type: 'base64';
+                }
+            }
+            /**
+             * Run this protein entity in single-sequence mode without an MSA.
+             */
+            interface Boltz2EmptyMsa {
+                type: 'empty';
+            }
         }
         interface RnaEntity {
             /**
@@ -1773,6 +1968,49 @@ export declare namespace StructureAndBindingEstimateCostParams {
              */
             step_scale?: number;
         }
+        interface Template {
+            /**
+             * Template structure format. Base64 sources must use a matching media_type.
+             */
+            format: 'cif' | 'pdb';
+            /**
+             * How to provide a file to the API
+             */
+            source: Template.URLSource | Template.Base64Source;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            chain_id?: string | Array<string>;
+            /**
+             * Force the template alignment within threshold.
+             */
+            force?: boolean;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            template_id?: string | Array<string>;
+            /**
+             * Distance threshold in angstroms used when force is true.
+             */
+            threshold?: number;
+        }
+        namespace Template {
+            interface URLSource {
+                type: 'url';
+                url: string;
+            }
+            interface Base64Source {
+                /**
+                 * Base64-encoded file contents
+                 */
+                data: string;
+                /**
+                 * MIME type (e.g., text/csv)
+                 */
+                media_type: string;
+                type: 'base64';
+            }
+        }
     }
 }
 export interface StructureAndBindingStartParams {
@@ -1796,7 +2034,7 @@ export declare namespace StructureAndBindingStartParams {
          * Entities (proteins, RNA, DNA, ligands) forming the complex to predict. Order
          * determines chain assignment.
          */
-        entities: Array<Input.ProteinEntity | Input.RnaEntity | Input.DnaEntity | Input.LigandCcdEntity | Input.LigandSmilesEntity>;
+        entities: Array<Input.Boltz2ProteinEntity | Input.RnaEntity | Input.DnaEntity | Input.LigandCcdEntity | Input.LigandSmilesEntity>;
         binding?: Input.LigandProteinBinding | Input.ProteinProteinBinding;
         /**
          * Bond constraints between atoms. Atom-level ligand references currently support
@@ -1813,9 +2051,14 @@ export declare namespace StructureAndBindingStartParams {
          * Number of structure samples to generate
          */
         num_samples?: number;
+        /**
+         * Template structure files to guide protein-chain prediction. Supports up to 4 CIF
+         * or PDB templates from HTTPS URLs or base64 uploads.
+         */
+        templates?: Array<Input.Template>;
     }
     namespace Input {
-        interface ProteinEntity {
+        interface Boltz2ProteinEntity {
             /**
              * Chain IDs for this entity
              */
@@ -1833,9 +2076,14 @@ export declare namespace StructureAndBindingStartParams {
              * Post-translational modifications. Optional; defaults to an empty list when
              * omitted.
              */
-            modifications?: Array<ProteinEntity.Modification>;
+            modifications?: Array<Boltz2ProteinEntity.Modification>;
+            /**
+             * Optional protein MSA control. Omit to use automatic MSA generation; use custom
+             * for user-provided A3M/CSV; use empty for single-sequence mode.
+             */
+            msa?: Boltz2ProteinEntity.Boltz2CustomMsa | Boltz2ProteinEntity.Boltz2EmptyMsa;
         }
-        namespace ProteinEntity {
+        namespace Boltz2ProteinEntity {
             interface Modification {
                 /**
                  * 0-based index of the residue to modify
@@ -1848,6 +2096,43 @@ export declare namespace StructureAndBindingStartParams {
                  */
                 value: string;
             }
+            /**
+             * Custom MSA file to use for this protein entity.
+             */
+            interface Boltz2CustomMsa {
+                /**
+                 * Custom MSA file format. Boltz supports A3M and CSV MSA files.
+                 */
+                format: 'a3m' | 'csv';
+                /**
+                 * How to provide a file to the API
+                 */
+                source: Boltz2CustomMsa.URLSource | Boltz2CustomMsa.Base64Source;
+                type: 'custom';
+            }
+            namespace Boltz2CustomMsa {
+                interface URLSource {
+                    type: 'url';
+                    url: string;
+                }
+                interface Base64Source {
+                    /**
+                     * Base64-encoded file contents
+                     */
+                    data: string;
+                    /**
+                     * MIME type (e.g., text/csv)
+                     */
+                    media_type: string;
+                    type: 'base64';
+                }
+            }
+            /**
+             * Run this protein entity in single-sequence mode without an MSA.
+             */
+            interface Boltz2EmptyMsa {
+                type: 'empty';
+            }
         }
         interface RnaEntity {
             /**
@@ -2155,6 +2440,49 @@ export declare namespace StructureAndBindingStartParams {
              */
             step_scale?: number;
         }
+        interface Template {
+            /**
+             * Template structure format. Base64 sources must use a matching media_type.
+             */
+            format: 'cif' | 'pdb';
+            /**
+             * How to provide a file to the API
+             */
+            source: Template.URLSource | Template.Base64Source;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            chain_id?: string | Array<string>;
+            /**
+             * Force the template alignment within threshold.
+             */
+            force?: boolean;
+            /**
+             * One query/template chain ID, or an ordered list of chain IDs.
+             */
+            template_id?: string | Array<string>;
+            /**
+             * Distance threshold in angstroms used when force is true.
+             */
+            threshold?: number;
+        }
+        namespace Template {
+            interface URLSource {
+                type: 'url';
+                url: string;
+            }
+            interface Base64Source {
+                /**
+                 * Base64-encoded file contents
+                 */
+                data: string;
+                /**
+                 * MIME type (e.g., text/csv)
+                 */
+                media_type: string;
+                type: 'base64';
+            }
+        }
     }
 }
 export declare namespace StructureAndBinding {

package/resources/predictions/structure-and-binding.d.mts.map

@@ -1 +1 @@
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