boltz-api 0.39.2 → 0.40.0
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 +16 -0
- package/package.json +1 -1
- package/resources/predictions/structure-and-binding.d.mts +108 -16
- package/resources/predictions/structure-and-binding.d.mts.map +1 -1
- package/resources/predictions/structure-and-binding.d.ts +108 -16
- package/resources/predictions/structure-and-binding.d.ts.map +1 -1
- package/resources/protein/design.d.mts +382 -44
- package/resources/protein/design.d.mts.map +1 -1
- package/resources/protein/design.d.ts +382 -44
- package/resources/protein/design.d.ts.map +1 -1
- package/resources/protein/library-screen.d.mts +216 -32
- package/resources/protein/library-screen.d.mts.map +1 -1
- package/resources/protein/library-screen.d.ts +216 -32
- package/resources/protein/library-screen.d.ts.map +1 -1
- package/resources/small-molecule/design.d.mts +85 -10
- package/resources/small-molecule/design.d.mts.map +1 -1
- package/resources/small-molecule/design.d.ts +85 -10
- package/resources/small-molecule/design.d.ts.map +1 -1
- package/resources/small-molecule/library-screen.d.mts +45 -10
- package/resources/small-molecule/library-screen.d.mts.map +1 -1
- package/resources/small-molecule/library-screen.d.ts +45 -10
- package/resources/small-molecule/library-screen.d.ts.map +1 -1
- package/src/resources/predictions/structure-and-binding.ts +108 -16
- package/src/resources/protein/design.ts +390 -44
- package/src/resources/protein/library-screen.ts +216 -32
- package/src/resources/small-molecule/design.ts +93 -10
- package/src/resources/small-molecule/library-screen.ts +45 -10
- 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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@@ -440,19 +440,26 @@ export namespace LibraryScreenRetrieveResponse {
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cyclic?: boolean;
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/**
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*
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* omitted.
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* CCD post-translational modifications. Optional; defaults to an empty list when
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* omitted. SMILES modifications are not supported.
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*/
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modifications?: Array<ProteinEntityResponse.Modification>;
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}
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export namespace ProteinEntityResponse {
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/**
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* Polymer residue modification. Only CCD codes are supported; SMILES modifications
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* are not accepted.
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*/
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export interface Modification {
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/**
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* 0-based index of the residue to modify
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*/
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residue_index: number;
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/**
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* Modification format. Only CCD polymer modifications are supported.
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*/
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type: 'ccd';
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/**
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@@ -482,18 +489,26 @@ export namespace LibraryScreenRetrieveResponse {
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cyclic?: boolean;
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/**
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*
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* CCD chemical modifications. Optional; defaults to an empty list when omitted.
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* SMILES modifications are not supported.
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*/
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modifications?: Array<RnaEntityResponse.Modification>;
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}
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export namespace RnaEntityResponse {
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/**
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* Polymer residue modification. Only CCD codes are supported; SMILES modifications
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* are not accepted.
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*/
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export interface Modification {
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/**
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* 0-based index of the residue to modify
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*/
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residue_index: number;
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/**
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* Modification format. Only CCD polymer modifications are supported.
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*/
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type: 'ccd';
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/**
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cyclic?: boolean;
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/**
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*
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* CCD chemical modifications. Optional; defaults to an empty list when omitted.
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* SMILES modifications are not supported.
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*/
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modifications?: Array<DnaEntityResponse.Modification>;
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}
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export namespace DnaEntityResponse {
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/**
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* Polymer residue modification. Only CCD codes are supported; SMILES modifications
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*/
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export interface Modification {
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*/
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residue_index: number;
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/**
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* Modification format. Only CCD polymer modifications are supported.
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*/
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type: 'ccd';
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/**
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/**
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* omitted. SMILES modifications are not supported.
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*/
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modifications?: Array<ProteinEntity.Modification>;
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}
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export namespace ProteinEntity {
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* Polymer residue modification. Only CCD codes are supported; SMILES modifications
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export interface Modification {
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residue_index: number;
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* Modification format. Only CCD polymer modifications are supported.
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*/
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type: 'ccd';
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/**
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/**
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*/
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modifications?: Array<RnaEntity.Modification>;
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}
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export namespace RnaEntity {
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* Polymer residue modification. Only CCD codes are supported; SMILES modifications
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*/
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export interface Modification {
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/**
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modifications?: Array<DnaEntity.Modification>;
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export namespace DnaEntity {
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export interface Modification {
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export namespace ProteinEntityResponse {
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export interface Modification {
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export namespace RnaEntityResponse {
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2341
|
* 0-based index of the residue to modify
|
|
2253
2342
|
*/
|
|
2254
2343
|
residue_index: number;
|
|
2255
2344
|
|
|
2345
|
+
/**
|
|
2346
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
2347
|
+
*/
|
|
2256
2348
|
type: 'ccd';
|
|
2257
2349
|
|
|
2258
2350
|
/**
|
|
@@ -2627,19 +2719,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2627
2719
|
cyclic?: boolean;
|
|
2628
2720
|
|
|
2629
2721
|
/**
|
|
2630
|
-
*
|
|
2631
|
-
* omitted.
|
|
2722
|
+
* CCD post-translational modifications. Optional; defaults to an empty list when
|
|
2723
|
+
* omitted. SMILES modifications are not supported.
|
|
2632
2724
|
*/
|
|
2633
2725
|
modifications?: Array<ProteinEntity.Modification>;
|
|
2634
2726
|
}
|
|
2635
2727
|
|
|
2636
2728
|
export namespace ProteinEntity {
|
|
2729
|
+
/**
|
|
2730
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
2731
|
+
* are not accepted.
|
|
2732
|
+
*/
|
|
2637
2733
|
export interface Modification {
|
|
2638
2734
|
/**
|
|
2639
2735
|
* 0-based index of the residue to modify
|
|
2640
2736
|
*/
|
|
2641
2737
|
residue_index: number;
|
|
2642
2738
|
|
|
2739
|
+
/**
|
|
2740
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
2741
|
+
*/
|
|
2643
2742
|
type: 'ccd';
|
|
2644
2743
|
|
|
2645
2744
|
/**
|
|
@@ -2669,18 +2768,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2669
2768
|
cyclic?: boolean;
|
|
2670
2769
|
|
|
2671
2770
|
/**
|
|
2672
|
-
*
|
|
2771
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
2772
|
+
* SMILES modifications are not supported.
|
|
2673
2773
|
*/
|
|
2674
2774
|
modifications?: Array<RnaEntity.Modification>;
|
|
2675
2775
|
}
|
|
2676
2776
|
|
|
2677
2777
|
export namespace RnaEntity {
|
|
2778
|
+
/**
|
|
2779
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
2780
|
+
* are not accepted.
|
|
2781
|
+
*/
|
|
2678
2782
|
export interface Modification {
|
|
2679
2783
|
/**
|
|
2680
2784
|
* 0-based index of the residue to modify
|
|
2681
2785
|
*/
|
|
2682
2786
|
residue_index: number;
|
|
2683
2787
|
|
|
2788
|
+
/**
|
|
2789
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
2790
|
+
*/
|
|
2684
2791
|
type: 'ccd';
|
|
2685
2792
|
|
|
2686
2793
|
/**
|
|
@@ -2710,18 +2817,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2710
2817
|
cyclic?: boolean;
|
|
2711
2818
|
|
|
2712
2819
|
/**
|
|
2713
|
-
*
|
|
2820
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
2821
|
+
* SMILES modifications are not supported.
|
|
2714
2822
|
*/
|
|
2715
2823
|
modifications?: Array<DnaEntity.Modification>;
|
|
2716
2824
|
}
|
|
2717
2825
|
|
|
2718
2826
|
export namespace DnaEntity {
|
|
2827
|
+
/**
|
|
2828
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
2829
|
+
* are not accepted.
|
|
2830
|
+
*/
|
|
2719
2831
|
export interface Modification {
|
|
2720
2832
|
/**
|
|
2721
2833
|
* 0-based index of the residue to modify
|
|
2722
2834
|
*/
|
|
2723
2835
|
residue_index: number;
|
|
2724
2836
|
|
|
2837
|
+
/**
|
|
2838
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
2839
|
+
*/
|
|
2725
2840
|
type: 'ccd';
|
|
2726
2841
|
|
|
2727
2842
|
/**
|
|
@@ -2920,19 +3035,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2920
3035
|
cyclic?: boolean;
|
|
2921
3036
|
|
|
2922
3037
|
/**
|
|
2923
|
-
*
|
|
2924
|
-
* omitted.
|
|
3038
|
+
* CCD post-translational modifications. Optional; defaults to an empty list when
|
|
3039
|
+
* omitted. SMILES modifications are not supported.
|
|
2925
3040
|
*/
|
|
2926
3041
|
modifications?: Array<ProteinEntity.Modification>;
|
|
2927
3042
|
}
|
|
2928
3043
|
|
|
2929
3044
|
export namespace ProteinEntity {
|
|
3045
|
+
/**
|
|
3046
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3047
|
+
* are not accepted.
|
|
3048
|
+
*/
|
|
2930
3049
|
export interface Modification {
|
|
2931
3050
|
/**
|
|
2932
3051
|
* 0-based index of the residue to modify
|
|
2933
3052
|
*/
|
|
2934
3053
|
residue_index: number;
|
|
2935
3054
|
|
|
3055
|
+
/**
|
|
3056
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3057
|
+
*/
|
|
2936
3058
|
type: 'ccd';
|
|
2937
3059
|
|
|
2938
3060
|
/**
|
|
@@ -2962,18 +3084,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
2962
3084
|
cyclic?: boolean;
|
|
2963
3085
|
|
|
2964
3086
|
/**
|
|
2965
|
-
*
|
|
3087
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3088
|
+
* SMILES modifications are not supported.
|
|
2966
3089
|
*/
|
|
2967
3090
|
modifications?: Array<RnaEntity.Modification>;
|
|
2968
3091
|
}
|
|
2969
3092
|
|
|
2970
3093
|
export namespace RnaEntity {
|
|
3094
|
+
/**
|
|
3095
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3096
|
+
* are not accepted.
|
|
3097
|
+
*/
|
|
2971
3098
|
export interface Modification {
|
|
2972
3099
|
/**
|
|
2973
3100
|
* 0-based index of the residue to modify
|
|
2974
3101
|
*/
|
|
2975
3102
|
residue_index: number;
|
|
2976
3103
|
|
|
3104
|
+
/**
|
|
3105
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3106
|
+
*/
|
|
2977
3107
|
type: 'ccd';
|
|
2978
3108
|
|
|
2979
3109
|
/**
|
|
@@ -3003,18 +3133,26 @@ export namespace LibraryScreenEstimateCostParams {
|
|
|
3003
3133
|
cyclic?: boolean;
|
|
3004
3134
|
|
|
3005
3135
|
/**
|
|
3006
|
-
*
|
|
3136
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3137
|
+
* SMILES modifications are not supported.
|
|
3007
3138
|
*/
|
|
3008
3139
|
modifications?: Array<DnaEntity.Modification>;
|
|
3009
3140
|
}
|
|
3010
3141
|
|
|
3011
3142
|
export namespace DnaEntity {
|
|
3143
|
+
/**
|
|
3144
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3145
|
+
* are not accepted.
|
|
3146
|
+
*/
|
|
3012
3147
|
export interface Modification {
|
|
3013
3148
|
/**
|
|
3014
3149
|
* 0-based index of the residue to modify
|
|
3015
3150
|
*/
|
|
3016
3151
|
residue_index: number;
|
|
3017
3152
|
|
|
3153
|
+
/**
|
|
3154
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3155
|
+
*/
|
|
3018
3156
|
type: 'ccd';
|
|
3019
3157
|
|
|
3020
3158
|
/**
|
|
@@ -3351,19 +3489,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3351
3489
|
cyclic?: boolean;
|
|
3352
3490
|
|
|
3353
3491
|
/**
|
|
3354
|
-
*
|
|
3355
|
-
* omitted.
|
|
3492
|
+
* CCD post-translational modifications. Optional; defaults to an empty list when
|
|
3493
|
+
* omitted. SMILES modifications are not supported.
|
|
3356
3494
|
*/
|
|
3357
3495
|
modifications?: Array<ProteinEntity.Modification>;
|
|
3358
3496
|
}
|
|
3359
3497
|
|
|
3360
3498
|
export namespace ProteinEntity {
|
|
3499
|
+
/**
|
|
3500
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3501
|
+
* are not accepted.
|
|
3502
|
+
*/
|
|
3361
3503
|
export interface Modification {
|
|
3362
3504
|
/**
|
|
3363
3505
|
* 0-based index of the residue to modify
|
|
3364
3506
|
*/
|
|
3365
3507
|
residue_index: number;
|
|
3366
3508
|
|
|
3509
|
+
/**
|
|
3510
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3511
|
+
*/
|
|
3367
3512
|
type: 'ccd';
|
|
3368
3513
|
|
|
3369
3514
|
/**
|
|
@@ -3393,18 +3538,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3393
3538
|
cyclic?: boolean;
|
|
3394
3539
|
|
|
3395
3540
|
/**
|
|
3396
|
-
*
|
|
3541
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3542
|
+
* SMILES modifications are not supported.
|
|
3397
3543
|
*/
|
|
3398
3544
|
modifications?: Array<RnaEntity.Modification>;
|
|
3399
3545
|
}
|
|
3400
3546
|
|
|
3401
3547
|
export namespace RnaEntity {
|
|
3548
|
+
/**
|
|
3549
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3550
|
+
* are not accepted.
|
|
3551
|
+
*/
|
|
3402
3552
|
export interface Modification {
|
|
3403
3553
|
/**
|
|
3404
3554
|
* 0-based index of the residue to modify
|
|
3405
3555
|
*/
|
|
3406
3556
|
residue_index: number;
|
|
3407
3557
|
|
|
3558
|
+
/**
|
|
3559
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3560
|
+
*/
|
|
3408
3561
|
type: 'ccd';
|
|
3409
3562
|
|
|
3410
3563
|
/**
|
|
@@ -3434,18 +3587,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3434
3587
|
cyclic?: boolean;
|
|
3435
3588
|
|
|
3436
3589
|
/**
|
|
3437
|
-
*
|
|
3590
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3591
|
+
* SMILES modifications are not supported.
|
|
3438
3592
|
*/
|
|
3439
3593
|
modifications?: Array<DnaEntity.Modification>;
|
|
3440
3594
|
}
|
|
3441
3595
|
|
|
3442
3596
|
export namespace DnaEntity {
|
|
3597
|
+
/**
|
|
3598
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3599
|
+
* are not accepted.
|
|
3600
|
+
*/
|
|
3443
3601
|
export interface Modification {
|
|
3444
3602
|
/**
|
|
3445
3603
|
* 0-based index of the residue to modify
|
|
3446
3604
|
*/
|
|
3447
3605
|
residue_index: number;
|
|
3448
3606
|
|
|
3607
|
+
/**
|
|
3608
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3609
|
+
*/
|
|
3449
3610
|
type: 'ccd';
|
|
3450
3611
|
|
|
3451
3612
|
/**
|
|
@@ -3644,19 +3805,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3644
3805
|
cyclic?: boolean;
|
|
3645
3806
|
|
|
3646
3807
|
/**
|
|
3647
|
-
*
|
|
3648
|
-
* omitted.
|
|
3808
|
+
* CCD post-translational modifications. Optional; defaults to an empty list when
|
|
3809
|
+
* omitted. SMILES modifications are not supported.
|
|
3649
3810
|
*/
|
|
3650
3811
|
modifications?: Array<ProteinEntity.Modification>;
|
|
3651
3812
|
}
|
|
3652
3813
|
|
|
3653
3814
|
export namespace ProteinEntity {
|
|
3815
|
+
/**
|
|
3816
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3817
|
+
* are not accepted.
|
|
3818
|
+
*/
|
|
3654
3819
|
export interface Modification {
|
|
3655
3820
|
/**
|
|
3656
3821
|
* 0-based index of the residue to modify
|
|
3657
3822
|
*/
|
|
3658
3823
|
residue_index: number;
|
|
3659
3824
|
|
|
3825
|
+
/**
|
|
3826
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3827
|
+
*/
|
|
3660
3828
|
type: 'ccd';
|
|
3661
3829
|
|
|
3662
3830
|
/**
|
|
@@ -3686,18 +3854,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3686
3854
|
cyclic?: boolean;
|
|
3687
3855
|
|
|
3688
3856
|
/**
|
|
3689
|
-
*
|
|
3857
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3858
|
+
* SMILES modifications are not supported.
|
|
3690
3859
|
*/
|
|
3691
3860
|
modifications?: Array<RnaEntity.Modification>;
|
|
3692
3861
|
}
|
|
3693
3862
|
|
|
3694
3863
|
export namespace RnaEntity {
|
|
3864
|
+
/**
|
|
3865
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3866
|
+
* are not accepted.
|
|
3867
|
+
*/
|
|
3695
3868
|
export interface Modification {
|
|
3696
3869
|
/**
|
|
3697
3870
|
* 0-based index of the residue to modify
|
|
3698
3871
|
*/
|
|
3699
3872
|
residue_index: number;
|
|
3700
3873
|
|
|
3874
|
+
/**
|
|
3875
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3876
|
+
*/
|
|
3701
3877
|
type: 'ccd';
|
|
3702
3878
|
|
|
3703
3879
|
/**
|
|
@@ -3727,18 +3903,26 @@ export namespace LibraryScreenStartParams {
|
|
|
3727
3903
|
cyclic?: boolean;
|
|
3728
3904
|
|
|
3729
3905
|
/**
|
|
3730
|
-
*
|
|
3906
|
+
* CCD chemical modifications. Optional; defaults to an empty list when omitted.
|
|
3907
|
+
* SMILES modifications are not supported.
|
|
3731
3908
|
*/
|
|
3732
3909
|
modifications?: Array<DnaEntity.Modification>;
|
|
3733
3910
|
}
|
|
3734
3911
|
|
|
3735
3912
|
export namespace DnaEntity {
|
|
3913
|
+
/**
|
|
3914
|
+
* Polymer residue modification. Only CCD codes are supported; SMILES modifications
|
|
3915
|
+
* are not accepted.
|
|
3916
|
+
*/
|
|
3736
3917
|
export interface Modification {
|
|
3737
3918
|
/**
|
|
3738
3919
|
* 0-based index of the residue to modify
|
|
3739
3920
|
*/
|
|
3740
3921
|
residue_index: number;
|
|
3741
3922
|
|
|
3923
|
+
/**
|
|
3924
|
+
* Modification format. Only CCD polymer modifications are supported.
|
|
3925
|
+
*/
|
|
3742
3926
|
type: 'ccd';
|
|
3743
3927
|
|
|
3744
3928
|
/**
|