@datagrok/sequence-translator 0.0.9 → 1.0.1
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/README.md +19 -11
- package/css/style.css +18 -0
- package/dist/package-test.js +2454 -0
- package/dist/package.js +5234 -0
- package/package.json +19 -10
- package/src/defineAxolabsPattern.ts +58 -55
- package/src/package-test.ts +1 -1
- package/src/package.ts +53 -50
- package/src/salts.ts +2 -2
- package/src/structures-works/from-monomers.ts +20 -12
- package/src/structures-works/mol-transformations.ts +34 -18
- package/src/structures-works/save-sense-antisense.ts +5 -2
- package/src/structures-works/sequence-codes-tools.ts +192 -93
- package/src/tests/smiles-tests.ts +31 -27
- package/{test-SequenceTranslator-2e08c8e54bde-1367d435.html → test-SequenceTranslator-089b6516ed77-2280593f.html} +2 -2
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@@ -1,5 +1,6 @@
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import {category, expect, test} from '@datagrok-libraries/utils/src/test';
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import {sequenceToSmiles} from '../structures-works/from-monomers';
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import {SYNTHESIZERS} from '../structures-works/map';
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category('sequence-translator', () => {
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test('AGGTCCTCTTGACTTAGGCC', async () => {
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@@ -23,7 +24,7 @@ category('sequence-translator', () => {
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](OC)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C=CC(N)=NC2(=O))C[C@@H]1OP(=O)(O)OC[C@H]1O[C@@H](N2C=CC(N)=NC2(=O))C[C@@H]1O';
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expect(sequenceToSmiles('AGGTCCTCTTGACTTAGGCC'), expected);
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expect(sequenceToSmiles('AGGTCCTCTTGACTTAGGCC', false, SYNTHESIZERS.RAW_NUCLEOTIDES), expected);
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});
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test('invabasic/galnac1', async () => {
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@@ -34,7 +35,7 @@ category('sequence-translator', () => {
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'OCC(O)CNC(=O)CCCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)';
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expect(sequenceToSmiles('(invabasic)sgg(invabasic)(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sgg(invabasic)(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('invabasic/galnac2', async () => {
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'OCC(O)CNC(=O)CCCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)';
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expect(sequenceToSmiles('(invabasic)sgsg(invabasic)(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sgsg(invabasic)(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('invabasic/galnac3', async () => {
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'OCC(O)CNC(=O)CCCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)';
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expect(sequenceToSmiles('(invabasic)sggs(invabasic)(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sggs(invabasic)(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('invabasic/galnac4', async () => {
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'OCC(O)CNC(=O)CCCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)' +
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'(COCCC(=O)NCCCNC(=O)CCCCOC2OC(CO)C(O)C(O)C2NC(=O)C)';
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expect(sequenceToSmiles('(invabasic)sgg(invabasic)s(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sgg(invabasic)s(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('usCfCfUfGfAf', async () => {
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'OC[C@H]1O[C@@H](N2C=CC(=O)NC2(=O))[C@H](F)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](F)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C3N=CN=C(N)C=3N=C2)[C@H](F)[C@@H]1O';
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expect(sequenceToSmiles('usCfCfUfGfAf'), expected);
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expect(sequenceToSmiles('usCfCfUfGfAf', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('usAfsusgsgsg', async () => {
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](OC)[C@@H]1OP(=O)(S)' +
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](OC)[C@@H]1OP(=O)(S)' +
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](OC)[C@@H]1O';
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expect(sequenceToSmiles('usAfsusgsgsg'), expected);
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expect(sequenceToSmiles('usAfsusgsgsg', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('UfUfUfsCfsuacg', async () => {
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'OC[C@H]1O[C@@H](N2C3N=CN=C(N)C=3N=C2)[C@H](OC)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C=CC(N)=NC2(=O))[C@H](OC)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](OC)[C@@H]1O';
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expect(sequenceToSmiles('UfUfUfsCfsuacg'), expected);
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expect(sequenceToSmiles('UfUfUfsCfsuacg', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('susususauasu', async () => {
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'OC[C@H]1O[C@@H](N2C=CC(=O)NC2(=O))[C@H](OC)[C@@H]1OP(=O)(O)' +
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'OC[C@H]1O[C@@H](N2C3N=CN=C(N)C=3N=C2)[C@H](OC)[C@@H]1OP(=O)(S)' +
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'OC[C@H]1O[C@@H](N2C=CC(=O)NC2(=O))[C@H](OC)[C@@H]1O';
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expect(sequenceToSmiles('susususauasu'), expected);
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expect(sequenceToSmiles('susususauasu', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('CfGfCfsGfsCf', async () => {
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'OC[C@H]1O[C@@H](N2C=CC(N)=NC2(=O))[C@H](F)[C@@H]1OP(=O)(S)' +
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'OC[C@H]1O[C@@H](N2C3N=C(N)NC(=O)C=3N=C2)[C@H](F)[C@@H]1OP(=O)(S)' +
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expect(sequenceToSmiles('CfGfCfsGfsCf'), expected);
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expect(sequenceToSmiles('CfGfCfsGfsCf', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('acacacsacsac', async () => {
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expect(sequenceToSmiles('acacacsacsac'), expected);
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expect(sequenceToSmiles('acacacsacsac', false, SYNTHESIZERS.AXOLABS), expected);
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test('cccgggusug', async () => {
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expect(sequenceToSmiles('cccgggusug'), expected);
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expect(sequenceToSmiles('cccgggusug', false, SYNTHESIZERS.AXOLABS), expected);
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test('UfAfCfGfGfCfAfUf', async () => {
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expect(sequenceToSmiles('UfAfCfGfGfCfAfUf'), expected);
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expect(sequenceToSmiles('UfAfCfGfGfCfAfUf', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)sucuCfuUf', async () => {
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expect(sequenceToSmiles('(invabasic)sucuCfuUf'), expected);
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expect(sequenceToSmiles('(invabasic)sucuCfuUf', false, SYNTHESIZERS.AXOLABS), expected);
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});
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test('(invabasic)sAfgcugUf', async () => {
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expect(sequenceToSmiles('(invabasic)sAfgcugUf'), expected);
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expect(sequenceToSmiles('(invabasic)sAfgcugUf', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)cuCfuUfsc', async () => {
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expect(sequenceToSmiles('(invabasic)cuCfuUfsc'), expected);
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expect(sequenceToSmiles('(invabasic)cuCfuUfsc', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)scususu(GalNAc-2-JNJ)', async () => {
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expect(sequenceToSmiles('(invabasic)scususu(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)scususu(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)usAfsucuCfuUfAfgcugUfgCfacususu', async () => {
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expect(sequenceToSmiles('(invabasic)usAfsucuCfuUfAfgcugUfgCfacususu'), expected);
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expect(sequenceToSmiles('(invabasic)usAfsucuCfuUfAfgcugUfgCfacususu', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)asacgGfuGfCfAfacucuauuca', async () => {
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expect(sequenceToSmiles('(invabasic)asacgGfuGfCfAfacucuauuca'), expected);
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expect(sequenceToSmiles('(invabasic)asacgGfuGfCfAfacucuauuca', false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)scsgguGfcAfAfCfucuauucuga', async () => {
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expect(sequenceToSmiles('(invabasic)sasacuCfuAfUfUfcuggacuuua'), expected);
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expect(sequenceToSmiles('(invabasic)sasacuCfuAfUfUfcuggacuuua', false, SYNTHESIZERS.AXOLABS), expected);
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expect(sequenceToSmiles('(invabasic)usAfscug(invabasic)(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sasuaaCfcUf(GalNAc-2-JNJ)'), expected);
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expect(sequenceToSmiles('(invabasic)sasuaaCfcUf(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS), expected);
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expect(sequenceToSmiles('(invabasic)sasuaaCfcUfCfUfuguaguuaua(GalNAc-2-JNJ)'
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expect(sequenceToSmiles('(invabasic)sasuaaCfcUfCfUfuguaguuaua(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS),
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expected);
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test('(invabasic)scsaucacguUfGfCfagccgucuua(invabasic)(GalNAc-2-JNJ)', async () => {
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expect(sequenceToSmiles('(invabasic)scsaucacguUfGfCfagccgucuua(invabasic)(GalNAc-2-JNJ)'
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expect(sequenceToSmiles('(invabasic)scsaucacguUfGfCfagccgucuua(invabasic)(GalNAc-2-JNJ)',
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false, SYNTHESIZERS.AXOLABS), expected);
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test('(invabasic)susguuUfgCfCfUfacaucuacua(GalNAc-2-JNJ)', async () => {
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expect(sequenceToSmiles('(invabasic)susguuUfgCfCfUfacaucuacua(GalNAc-2-JNJ)'
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expect(sequenceToSmiles('(invabasic)susguuUfgCfCfUfacaucuacua(GalNAc-2-JNJ)', false, SYNTHESIZERS.AXOLABS),
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expected);
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<html><head><meta charset="utf-8"/><title>SequenceTranslator Test Report. Datagrok version datagrok/datagrok:latest SHA=089b6516ed77. Commit 2280593f.</title><style type="text/css">html,
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</style></head><body><div id="jesthtml-content"><header><h1 id="title">SequenceTranslator Test Report. Datagrok version datagrok/datagrok:latest SHA=
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</style></head><body><div id="jesthtml-content"><header><h1 id="title">SequenceTranslator Test Report. Datagrok version datagrok/datagrok:latest SHA=089b6516ed77. Commit 2280593f.</h1></header><div id="metadata-container"><div id="timestamp">Started: 2022-06-09 16:25:38</div><div id="summary"><div id="suite-summary"><div class="summary-total">Suites (1)</div><div class="summary-passed summary-empty">0 passed</div><div class="summary-failed">1 failed</div><div class="summary-pending summary-empty">0 pending</div></div><div id="test-summary"><div class="summary-total">Tests (1)</div><div class="summary-passed summary-empty">0 passed</div><div class="summary-failed">1 failed</div><div class="summary-pending summary-empty">0 pending</div></div></div></div><div id="suite-1" class="suite-container"><div class="suite-info"><div class="suite-path">/home/runner/work/public/public/packages/SequenceTranslator/src/__jest__/remote.test.ts</div><div class="suite-time warn">13.491s</div></div><div class="suite-tests"><div class="test-result failed"><div class="test-info"><div class="test-suitename"> </div><div class="test-title">TEST</div><div class="test-status">failed</div><div class="test-duration">0.623s</div></div><div class="failureMessages"> <pre class="failureMsg">Error: Evaluation failed: Unable to find JS function "test"
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at ExecutionContext._evaluateInternal (/home/runner/work/public/public/packages/SequenceTranslator/node_modules/puppeteer/src/common/ExecutionContext.ts:273:13)
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at ExecutionContext.evaluate (/home/runner/work/public/public/packages/SequenceTranslator/node_modules/puppeteer/src/common/ExecutionContext.ts:140:12)</pre></div></div></div><div class="suite-consolelog"><div class="suite-consolelog-header">Console Log</div><div class="suite-consolelog-item"><pre class="suite-consolelog-item-origin"> at Object.<anonymous> (/home/runner/work/public/public/packages/SequenceTranslator/src/__jest__/test-node.ts:62:11)
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