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@datagrok/bio

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@datagrok/bio - npm Package Compare versions

Comparing version 1.5.8 to 1.5.9

files/samples/testDemog.csv

14

detectors.js

@@ -78,4 +78,4 @@ /**

const forbidden = BioPackageDetectors.checkForbiddenWoSeparator(stats.freq);
if (separator || !forbidden) {
// const forbidden = BioPackageDetectors.checkForbiddenWoSeparator(stats.freq);
if (separator || alphabet != 'UN') {
const units = `${format}:${seqType}:${alphabet}`;

@@ -127,7 +127,7 @@ col.setTag(DG.TAGS.UNITS, units);

/** Without a separator, special symbols or digits are not allowed as monomers. */
static checkForbiddenWoSeparator(freq) {
const forbiddenRe = /[\d!@#$%^&*()_+\-=\[\]{};':"\\|,.<>\/?]/i;
return Object.keys(freq).filter((m) => forbiddenRe.test(m)).length > 0;
}
// /** Without a separator, special symbols or digits are not allowed as monomers. */
// static checkForbiddenWoSeparator(freq) {
// const forbiddenRe = /[\d!@#$%^&*()_+\-=\[\]{};':"\\|,.<>\/?]/i;
// return Object.keys(freq).filter((m) => forbiddenRe.test(m)).length > 0;
// }

@@ -134,0 +134,0 @@ /** Stats of sequences with specified splitter func, returns { freq, sameLength } */

@@ -5,3 +5,3 @@ {

"friendlyName": "Bio",
"version": "1.5.8",
"version": "1.5.9",
"description": "Bio is a [package](https://datagrok.ai/help/develop/develop#packages) for the [Datagrok](https://datagrok.ai) platform",

@@ -8,0 +8,0 @@ "repository": {

@@ -108,5 +108,7 @@ import {after, before, category, test, expect, expectObject} from '@datagrok-libraries/utils/src/test';

msaComplex = 'msaComplex',
idCsv = 'idCsv',
sarSmallCsv = 'sarSmallCsv',
helmCsv = 'helmCsv',
testIdCsv = 'testIdCsv',
testSmilesCsv = 'testSmilesCsv',
testHelmCsv = 'testHelmCsv',
testDemogCsv = 'testDemogCsv',
}

@@ -119,5 +121,7 @@

'msaComplex': 'System:AppData/Bio/samples/sample_MSA.csv',
'idCsv': 'System:AppData/Bio/samples/id.csv',
'sarSmallCsv': 'System:AppData/Bio/samples/sar-small.csv',
'helmCsv': 'System:AppData/Bio/samples/sample_HELM.csv',
'testDemogCsv': 'System:AppData/Bio/samples/testDemog.csv',
'testIdCsv': 'System:AppData/Bio/samples/id.csv',
'testHelmCsv': 'System:AppData/Bio/samples/testHelm.csv',
'testSmilesCsv': 'System:AppData/Bio/samples/testSmiles.csv',
};

@@ -243,7 +247,7 @@

test('samplesIdCsvNegativeID', async () => {
await _testNeg(readSamples(Samples.idCsv), 'ID');
await _testNeg(readSamples(Samples.testIdCsv), 'ID');
});
test('samplesSarSmallCsvNegativeSmiles', async () => {
await _testNeg(readSamples(Samples.sarSmallCsv), 'smiles');
await _testNeg(readSamples(Samples.testSmilesCsv), 'smiles');
});

@@ -258,2 +262,34 @@

});
// sample_testHelm.csb
// columns: ID,Test type,HELM string,Valid?,Mol Weight,Mol Formula,SMILES
test('samplesTestHelmNegativeID', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'ID');
});
test('samplesTestHelmNegativeTestType', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'Test type');
});
test('samplesTestHelmPositiveHelmString', async () => {
await _testPos(readSamples(Samples.testHelmCsv), 'HELM string', 'HELM');
});
test('samplesTestHelmNegativeValid', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'Valid?');
});
test('samplesTestHelmNegativeMolWeight', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'Mol Weight');
});
test('samplesTestHelmNegativeMolFormula', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'Mol Formula');
});
test('samplesTestHelmNegativeSmiles', async () => {
await _testNeg(readSamples(Samples.testHelmCsv), 'Smiles');
});
test('samplesTestDemogNegativeAll', async () => {
const dfFunc: DfReaderFunc = readSamples(Samples.testDemogCsv);
const df: DG.DataFrame = await dfFunc();
for (const col of df.columns.toList())
await _testNeg(dfFunc, col.name);
});
});

@@ -260,0 +296,0 @@

@@ -12,3 +12,3 @@ import * as C from "./constants";

const lru = new DG.LruCache<any, any>();
const lru = new DG.LruCache<any, any>();

@@ -131,5 +131,2 @@ function getPalleteByType(paletteType: string): SeqPalette {

export class MacromoleculeSequenceCellRenderer extends DG.GridCellRenderer {
constructor() {
super();
}

@@ -167,3 +164,3 @@ get name(): string {return 'macromoleculeSequence';}

host.setAttribute('data', gridCell.cell.value);
gridCell.element = host;
//@ts-ignore

@@ -192,17 +189,17 @@ var canvas = new JSDraw2.Editor(host, { width: w, height: h, skin: "w8", viewonly: true });

const s: string = cell.value ?? '';
//TODO: can this be replaced/merged with splitSequence?
const units = gridCell.cell.column.getTag(DG.TAGS.UNITS);
const palette = getPalleteByType(paletteType);
const separator = gridCell.cell.column.getTag('separator') ?? '';
const splitterFunc: SplitterFunc = WebLogo.getSplitter(units, gridCell.cell.column.getTag('separator') );// splitter,
const subParts:string[] = splitterFunc(cell.value);
console.log(subParts);
const textSize = g.measureText(subParts.join(''));
let x1 = Math.max(x, x + (w - textSize.width) / 2);
subParts.forEach((amino, index) => {

@@ -214,3 +211,3 @@ let [color, outerAmino,, pivot] = ChemPalette.getColorAAPivot(amino);

});
g.restore();

@@ -217,0 +214,0 @@ }

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Sorry, the diff of this file is too big to display

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