boltz-api 0.44.0 → 0.45.0
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/CHANGELOG.md +17 -0
- package/client.d.mts +2 -2
- package/client.d.ts +2 -2
- package/client.js +2 -2
- package/client.mjs +2 -2
- package/package.json +1 -1
- package/resources/admin/workspaces.d.mts +1 -1
- package/resources/admin/workspaces.d.ts +1 -1
- package/resources/admin/workspaces.js +1 -1
- package/resources/admin/workspaces.mjs +1 -1
- package/resources/predictions/index.d.mts +1 -1
- package/resources/predictions/index.d.mts.map +1 -1
- package/resources/predictions/index.d.ts +1 -1
- package/resources/predictions/index.d.ts.map +1 -1
- package/resources/predictions/index.js.map +1 -1
- package/resources/predictions/index.mjs.map +1 -1
- package/resources/predictions/predictions.d.mts +2 -2
- package/resources/predictions/predictions.d.mts.map +1 -1
- package/resources/predictions/predictions.d.ts +2 -2
- package/resources/predictions/predictions.d.ts.map +1 -1
- package/resources/predictions/predictions.js.map +1 -1
- package/resources/predictions/predictions.mjs.map +1 -1
- package/resources/predictions/structure-and-binding.d.mts +553 -1
- package/resources/predictions/structure-and-binding.d.mts.map +1 -1
- package/resources/predictions/structure-and-binding.d.ts +553 -1
- package/resources/predictions/structure-and-binding.d.ts.map +1 -1
- package/resources/predictions/structure-and-binding.js +30 -0
- package/resources/predictions/structure-and-binding.js.map +1 -1
- package/resources/predictions/structure-and-binding.mjs +30 -0
- package/resources/predictions/structure-and-binding.mjs.map +1 -1
- package/resources/protein/design.d.mts +87 -50
- package/resources/protein/design.d.mts.map +1 -1
- package/resources/protein/design.d.ts +87 -50
- package/resources/protein/design.d.ts.map +1 -1
- package/resources/protein/library-screen.d.mts +62 -30
- package/resources/protein/library-screen.d.mts.map +1 -1
- package/resources/protein/library-screen.d.ts +62 -30
- package/resources/protein/library-screen.d.ts.map +1 -1
- package/resources/protein/protein.d.mts +1 -1
- package/resources/protein/protein.d.ts +1 -1
- package/resources/protein/protein.js +1 -1
- package/resources/protein/protein.mjs +1 -1
- package/resources/small-molecule/design.d.mts +52 -20
- package/resources/small-molecule/design.d.mts.map +1 -1
- package/resources/small-molecule/design.d.ts +52 -20
- package/resources/small-molecule/design.d.ts.map +1 -1
- package/resources/small-molecule/library-screen.d.mts +52 -20
- package/resources/small-molecule/library-screen.d.mts.map +1 -1
- package/resources/small-molecule/library-screen.d.ts +52 -20
- package/resources/small-molecule/library-screen.d.ts.map +1 -1
- package/resources/small-molecule/small-molecule.d.mts +1 -1
- package/resources/small-molecule/small-molecule.d.ts +1 -1
- package/resources/small-molecule/small-molecule.js +1 -1
- package/resources/small-molecule/small-molecule.mjs +1 -1
- package/src/client.ts +2 -2
- package/src/resources/admin/workspaces.ts +1 -1
- package/src/resources/predictions/index.ts +2 -0
- package/src/resources/predictions/predictions.ts +4 -0
- package/src/resources/predictions/structure-and-binding.ts +675 -0
- package/src/resources/protein/design.ts +95 -50
- package/src/resources/protein/library-screen.ts +70 -30
- package/src/resources/protein/protein.ts +1 -1
- package/src/resources/small-molecule/design.ts +60 -20
- package/src/resources/small-molecule/library-screen.ts +60 -20
- package/src/resources/small-molecule/small-molecule.ts +1 -1
- package/src/version.ts +1 -1
- package/version.d.mts +1 -1
- package/version.d.ts +1 -1
- package/version.js +1 -1
- package/version.mjs +1 -1
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@@ -184,7 +184,7 @@ export type DesignListResponsesCursorPage = CursorPage<DesignListResponse>;
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export type DesignListResultsResponsesCursorPage = CursorPage<DesignListResultsResponse>;
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/**
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* A protein design
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* A protein design pipeline run that generates novel protein binders
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*/
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export interface DesignRetrieveResponse {
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/**
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data_deleted_at: string | null;
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/**
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*
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* @deprecated Use pipeline instead.
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*/
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engine: '
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engine: 'boltzprot';
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/**
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engine_version: '1.0';
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error: DesignRetrieveResponse.Error | null;
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*/
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livemode: boolean;
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/**
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* Pipeline used for protein design
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*/
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pipeline: 'boltzprot';
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/**
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* Pipeline version used for protein design
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*/
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pipeline_version: '1.0';
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progress: DesignRetrieveResponse.Progress | null;
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started_at: string | null;
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* Binder specification starting from an existing 3D structure. Upload a CIF/PDB
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* file and select which chains to include, which residues to keep, and which
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* regions to redesign. Only chains included in chain_selection are part of the
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*
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* pipeline run.
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export interface StructureTemplateBinderSpecResponse {
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* Chains selected from the uploaded binder structure, keyed by chain ID. Only
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* mapping are ignored. Each value defines which residues to keep
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* chains listed here are included in the pipeline run — any chains omitted from
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* this mapping are ignored. Each value defines which residues to keep
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* (crop_residues). Omit design_motifs to include the chain as fixed scaffold
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* context.
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chain_selection: {
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[key: string]:
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export interface StructureTemplateTargetResponse {
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/**
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* Chains selected from the uploaded structure, keyed by chain ID. Only chains
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* listed here are included in the pipeline run — any chains omitted from this
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* mapping are ignored. Each value defines which residues to keep, which are
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* epitope residues, which are non-binding residues, and which are flexible.
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/**
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* 0-indexed residue indices to retain from this chain, or 'all' to keep all
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* residues. Residues not listed are excluded from the
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* residues. Residues not listed are excluded from the pipeline run.
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crop_residues: Array<number> | 'all';
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}
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/**
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* Summary of a protein design
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* Summary of a protein design pipeline run (excludes input)
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export interface DesignListResponse {
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/**
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error: DesignListResponse.Error | null;
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*/
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* Pipeline used for protein design
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*/
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pipeline: 'boltzprot';
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progress: DesignListResponse.Progress | null;
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export interface DesignStartResponse {
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export interface StructureTemplateBinderSpecResponse {
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* mapping are ignored. Each value defines which residues to keep, which are
|
|
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* epitope residues, which are non-binding residues, and which are flexible.
|
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*/
|
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@@ -3984,7 +4027,7 @@ export namespace DesignStopResponse {
|
|
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|
|
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|
/**
|
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* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
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* residues. Residues not listed are excluded from the
|
|
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* residues. Residues not listed are excluded from the pipeline run.
|
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crop_residues: Array<number> | 'all';
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|
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* Binder specification starting from an existing 3D structure. Upload a CIF/PDB
|
|
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* file and select which chains to include, which residues to keep, and which
|
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* regions to redesign. Only chains included in chain_selection are part of the
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|
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*
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* pipeline run.
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|
export interface StructureTemplateBinderSpec {
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/**
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|
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* chains listed here are included in the
|
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* mapping are ignored. Each value defines which residues to keep
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* Omit design_motifs to include the chain as fixed scaffold
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* chains listed here are included in the pipeline run — any chains omitted from
|
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* this mapping are ignored. Each value defines which residues to keep
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* (crop_residues). Omit design_motifs to include the chain as fixed scaffold
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* context.
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*/
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chain_selection: {
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[key: string]:
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export interface StructureTemplateTarget {
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/**
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* listed here are included in the
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* listed here are included in the pipeline run — any chains omitted from this
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* mapping are ignored. Each value defines which residues to keep, which are
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* epitope residues, which are non-binding residues, and which are flexible.
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*/
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/**
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* residues. Residues not listed are excluded from the
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* residues. Residues not listed are excluded from the pipeline run.
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*/
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crop_residues: Array<number> | 'all';
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* Binder specification starting from an existing 3D structure. Upload a CIF/PDB
|
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* file and select which chains to include, which residues to keep, and which
|
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* regions to redesign. Only chains included in chain_selection are part of the
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*
|
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* pipeline run.
|
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|
*/
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|
export interface StructureTemplateBinderSpec {
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/**
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* Chains selected from the uploaded binder structure, keyed by chain ID. Only
|
|
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|
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* chains listed here are included in the
|
|
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|
-
* mapping are ignored. Each value defines which residues to keep
|
|
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|
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* Omit design_motifs to include the chain as fixed scaffold
|
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|
+
* chains listed here are included in the pipeline run — any chains omitted from
|
|
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|
+
* this mapping are ignored. Each value defines which residues to keep
|
|
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|
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* (crop_residues). Omit design_motifs to include the chain as fixed scaffold
|
|
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|
+
* context.
|
|
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|
*/
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chain_selection: {
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[key: string]:
|
|
@@ -6410,7 +6455,7 @@ export namespace DesignStartParams {
|
|
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export interface StructureTemplateTarget {
|
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|
/**
|
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|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
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|
-
* listed here are included in the
|
|
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|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
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|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
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|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
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|
*/
|
|
@@ -6439,7 +6484,7 @@ export namespace DesignStartParams {
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|
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|
/**
|
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|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
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|
-
* residues. Residues not listed are excluded from the
|
|
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|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
6443
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|
*/
|
|
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|
crop_residues: Array<number> | 'all';
|
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|
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@@ -189,7 +189,7 @@ export type LibraryScreenListResponsesCursorPage = CursorPage<LibraryScreenListR
|
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export type LibraryScreenListResultsResponsesCursorPage = CursorPage<LibraryScreenListResultsResponse>;
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|
/**
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* A protein library screening
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* A protein library screening pipeline run
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|
*/
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|
export interface LibraryScreenRetrieveResponse {
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/**
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@@ -208,14 +208,14 @@ export interface LibraryScreenRetrieveResponse {
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|
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/**
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*
|
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|
+
* @deprecated Use pipeline instead.
|
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|
*/
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engine: '
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|
+
engine: 'boltzprot';
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|
/**
|
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|
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*
|
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|
+
* @deprecated Use pipeline_version instead.
|
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|
*/
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|
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engine_version:
|
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|
+
engine_version: '1.0';
|
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|
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|
error: LibraryScreenRetrieveResponse.Error | null;
|
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|
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@@ -229,6 +229,16 @@ export interface LibraryScreenRetrieveResponse {
|
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|
*/
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|
livemode: boolean;
|
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|
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|
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/**
|
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|
+
* Pipeline used for protein library screen
|
|
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|
+
*/
|
|
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|
+
pipeline: 'boltzprot';
|
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|
+
|
|
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|
+
/**
|
|
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|
+
* Pipeline version used for protein library screen
|
|
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|
+
*/
|
|
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|
+
pipeline_version: '1.0';
|
|
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|
+
|
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|
progress: LibraryScreenRetrieveResponse.Progress | null;
|
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|
|
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|
started_at: string | null;
|
|
@@ -298,7 +308,7 @@ export namespace LibraryScreenRetrieveResponse {
|
|
|
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|
export interface StructureTemplateTargetResponse {
|
|
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|
/**
|
|
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310
|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
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|
-
* listed here are included in the
|
|
311
|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
302
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|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
303
313
|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
304
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|
*/
|
|
@@ -323,7 +333,7 @@ export namespace LibraryScreenRetrieveResponse {
|
|
|
323
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|
|
|
324
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|
/**
|
|
325
335
|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
326
|
-
* residues. Residues not listed are excluded from the
|
|
336
|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
327
337
|
*/
|
|
328
338
|
crop_residues: Array<number> | 'all';
|
|
329
339
|
|
|
@@ -850,7 +860,7 @@ export namespace LibraryScreenRetrieveResponse {
|
|
|
850
860
|
}
|
|
851
861
|
|
|
852
862
|
/**
|
|
853
|
-
* Summary of a protein library screening
|
|
863
|
+
* Summary of a protein library screening pipeline run (excludes input)
|
|
854
864
|
*/
|
|
855
865
|
export interface LibraryScreenListResponse {
|
|
856
866
|
/**
|
|
@@ -869,14 +879,14 @@ export interface LibraryScreenListResponse {
|
|
|
869
879
|
data_deleted_at: string | null;
|
|
870
880
|
|
|
871
881
|
/**
|
|
872
|
-
*
|
|
882
|
+
* @deprecated Use pipeline instead.
|
|
873
883
|
*/
|
|
874
|
-
engine: '
|
|
884
|
+
engine: 'boltzprot';
|
|
875
885
|
|
|
876
886
|
/**
|
|
877
|
-
*
|
|
887
|
+
* @deprecated Use pipeline_version instead.
|
|
878
888
|
*/
|
|
879
|
-
engine_version:
|
|
889
|
+
engine_version: '1.0';
|
|
880
890
|
|
|
881
891
|
error: LibraryScreenListResponse.Error | null;
|
|
882
892
|
|
|
@@ -885,6 +895,16 @@ export interface LibraryScreenListResponse {
|
|
|
885
895
|
*/
|
|
886
896
|
livemode: boolean;
|
|
887
897
|
|
|
898
|
+
/**
|
|
899
|
+
* Pipeline used for protein library screen
|
|
900
|
+
*/
|
|
901
|
+
pipeline: 'boltzprot';
|
|
902
|
+
|
|
903
|
+
/**
|
|
904
|
+
* Pipeline version used for protein library screen
|
|
905
|
+
*/
|
|
906
|
+
pipeline_version: '1.0';
|
|
907
|
+
|
|
888
908
|
progress: LibraryScreenListResponse.Progress | null;
|
|
889
909
|
|
|
890
910
|
started_at: string | null;
|
|
@@ -1315,7 +1335,7 @@ export namespace LibraryScreenListResultsResponse {
|
|
|
1315
1335
|
}
|
|
1316
1336
|
|
|
1317
1337
|
/**
|
|
1318
|
-
* A protein library screening
|
|
1338
|
+
* A protein library screening pipeline run
|
|
1319
1339
|
*/
|
|
1320
1340
|
export interface LibraryScreenStartResponse {
|
|
1321
1341
|
/**
|
|
@@ -1334,14 +1354,14 @@ export interface LibraryScreenStartResponse {
|
|
|
1334
1354
|
data_deleted_at: string | null;
|
|
1335
1355
|
|
|
1336
1356
|
/**
|
|
1337
|
-
*
|
|
1357
|
+
* @deprecated Use pipeline instead.
|
|
1338
1358
|
*/
|
|
1339
|
-
engine: '
|
|
1359
|
+
engine: 'boltzprot';
|
|
1340
1360
|
|
|
1341
1361
|
/**
|
|
1342
|
-
*
|
|
1362
|
+
* @deprecated Use pipeline_version instead.
|
|
1343
1363
|
*/
|
|
1344
|
-
engine_version:
|
|
1364
|
+
engine_version: '1.0';
|
|
1345
1365
|
|
|
1346
1366
|
error: LibraryScreenStartResponse.Error | null;
|
|
1347
1367
|
|
|
@@ -1355,6 +1375,16 @@ export interface LibraryScreenStartResponse {
|
|
|
1355
1375
|
*/
|
|
1356
1376
|
livemode: boolean;
|
|
1357
1377
|
|
|
1378
|
+
/**
|
|
1379
|
+
* Pipeline used for protein library screen
|
|
1380
|
+
*/
|
|
1381
|
+
pipeline: 'boltzprot';
|
|
1382
|
+
|
|
1383
|
+
/**
|
|
1384
|
+
* Pipeline version used for protein library screen
|
|
1385
|
+
*/
|
|
1386
|
+
pipeline_version: '1.0';
|
|
1387
|
+
|
|
1358
1388
|
progress: LibraryScreenStartResponse.Progress | null;
|
|
1359
1389
|
|
|
1360
1390
|
started_at: string | null;
|
|
@@ -1424,7 +1454,7 @@ export namespace LibraryScreenStartResponse {
|
|
|
1424
1454
|
export interface StructureTemplateTargetResponse {
|
|
1425
1455
|
/**
|
|
1426
1456
|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
1427
|
-
* listed here are included in the
|
|
1457
|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
1428
1458
|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
1429
1459
|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
1430
1460
|
*/
|
|
@@ -1449,7 +1479,7 @@ export namespace LibraryScreenStartResponse {
|
|
|
1449
1479
|
|
|
1450
1480
|
/**
|
|
1451
1481
|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
1452
|
-
* residues. Residues not listed are excluded from the
|
|
1482
|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
1453
1483
|
*/
|
|
1454
1484
|
crop_residues: Array<number> | 'all';
|
|
1455
1485
|
|
|
@@ -1976,7 +2006,7 @@ export namespace LibraryScreenStartResponse {
|
|
|
1976
2006
|
}
|
|
1977
2007
|
|
|
1978
2008
|
/**
|
|
1979
|
-
* A protein library screening
|
|
2009
|
+
* A protein library screening pipeline run
|
|
1980
2010
|
*/
|
|
1981
2011
|
export interface LibraryScreenStopResponse {
|
|
1982
2012
|
/**
|
|
@@ -1995,14 +2025,14 @@ export interface LibraryScreenStopResponse {
|
|
|
1995
2025
|
data_deleted_at: string | null;
|
|
1996
2026
|
|
|
1997
2027
|
/**
|
|
1998
|
-
*
|
|
2028
|
+
* @deprecated Use pipeline instead.
|
|
1999
2029
|
*/
|
|
2000
|
-
engine: '
|
|
2030
|
+
engine: 'boltzprot';
|
|
2001
2031
|
|
|
2002
2032
|
/**
|
|
2003
|
-
*
|
|
2033
|
+
* @deprecated Use pipeline_version instead.
|
|
2004
2034
|
*/
|
|
2005
|
-
engine_version:
|
|
2035
|
+
engine_version: '1.0';
|
|
2006
2036
|
|
|
2007
2037
|
error: LibraryScreenStopResponse.Error | null;
|
|
2008
2038
|
|
|
@@ -2016,6 +2046,16 @@ export interface LibraryScreenStopResponse {
|
|
|
2016
2046
|
*/
|
|
2017
2047
|
livemode: boolean;
|
|
2018
2048
|
|
|
2049
|
+
/**
|
|
2050
|
+
* Pipeline used for protein library screen
|
|
2051
|
+
*/
|
|
2052
|
+
pipeline: 'boltzprot';
|
|
2053
|
+
|
|
2054
|
+
/**
|
|
2055
|
+
* Pipeline version used for protein library screen
|
|
2056
|
+
*/
|
|
2057
|
+
pipeline_version: '1.0';
|
|
2058
|
+
|
|
2019
2059
|
progress: LibraryScreenStopResponse.Progress | null;
|
|
2020
2060
|
|
|
2021
2061
|
started_at: string | null;
|
|
@@ -2085,7 +2125,7 @@ export namespace LibraryScreenStopResponse {
|
|
|
2085
2125
|
export interface StructureTemplateTargetResponse {
|
|
2086
2126
|
/**
|
|
2087
2127
|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
2088
|
-
* listed here are included in the
|
|
2128
|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
2089
2129
|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
2090
2130
|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
2091
2131
|
*/
|
|
@@ -2110,7 +2150,7 @@ export namespace LibraryScreenStopResponse {
|
|
|
2110
2150
|
|
|
2111
2151
|
/**
|
|
2112
2152
|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
2113
|
-
* residues. Residues not listed are excluded from the
|
|
2153
|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
2114
2154
|
*/
|
|
2115
2155
|
crop_residues: Array<number> | 'all';
|
|
2116
2156
|
|
|
@@ -2883,7 +2923,7 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2883
2923
|
export interface StructureTemplateTarget {
|
|
2884
2924
|
/**
|
|
2885
2925
|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
2886
|
-
* listed here are included in the
|
|
2926
|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
2887
2927
|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
2888
2928
|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
2889
2929
|
*/
|
|
@@ -2912,7 +2952,7 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2912
2952
|
|
|
2913
2953
|
/**
|
|
2914
2954
|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
2915
|
-
* residues. Residues not listed are excluded from the
|
|
2955
|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
2916
2956
|
*/
|
|
2917
2957
|
crop_residues: Array<number> | 'all';
|
|
2918
2958
|
|
|
@@ -3653,7 +3693,7 @@ export namespace LibraryScreenStartParams {
|
|
|
3653
3693
|
export interface StructureTemplateTarget {
|
|
3654
3694
|
/**
|
|
3655
3695
|
* Chains selected from the uploaded structure, keyed by chain ID. Only chains
|
|
3656
|
-
* listed here are included in the
|
|
3696
|
+
* listed here are included in the pipeline run — any chains omitted from this
|
|
3657
3697
|
* mapping are ignored. Each value defines which residues to keep, which are
|
|
3658
3698
|
* epitope residues, which are non-binding residues, and which are flexible.
|
|
3659
3699
|
*/
|
|
@@ -3682,7 +3722,7 @@ export namespace LibraryScreenStartParams {
|
|
|
3682
3722
|
|
|
3683
3723
|
/**
|
|
3684
3724
|
* 0-indexed residue indices to retain from this chain, or 'all' to keep all
|
|
3685
|
-
* residues. Residues not listed are excluded from the
|
|
3725
|
+
* residues. Residues not listed are excluded from the pipeline run.
|
|
3686
3726
|
*/
|
|
3687
3727
|
crop_residues: Array<number> | 'all';
|
|
3688
3728
|
|
|
@@ -39,7 +39,7 @@ import {
|
|
|
39
39
|
} from './library-screen';
|
|
40
40
|
|
|
41
41
|
/**
|
|
42
|
-
* Protein
|
|
42
|
+
* Protein Pipeline — design novel protein binders and screen protein libraries against targets. Includes de novo protein design and library screening.
|
|
43
43
|
*/
|
|
44
44
|
export class Protein extends APIResource {
|
|
45
45
|
design: DesignAPI.Design = new DesignAPI.Design(this._client);
|