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Global-Chem
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global-chem
A Knowledge Graph of Common Chemical Names to their Molecular Definition
https://globalchemistry.org/
Mozilla Public License 2.0
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SS-141: What is Popular in the Black Market?
#236
Sulstice
closed
4 months ago
0
SS-139 PR: Cannabis Sativa Constituents Split into Different Categories.
#235
Sulstice
closed
1 year ago
0
SS-141: Remove All SMARTS
#234
Sulstice
closed
4 months ago
0
SS-140: Academic Codes for User Academic Verification if Chosen.
#233
Sulstice
closed
4 months ago
0
SS-139: Data Governance over Cannabis Sativa And Asteroid Ryugu
#232
Sulstice
closed
4 months ago
0
SS-138: added pyiodide wheels
#231
Sulstice
closed
1 year ago
3
SS-138: Porting Global-Chem into Github Action Bot
#230
Sulstice
closed
4 months ago
0
PCA-dashboard
#229
LadyBluenotes
closed
8 months ago
4
SG-1: Dashboard for Principal Component Analysis
#228
Sulstice
closed
4 months ago
3
[pre-commit.ci] pre-commit autoupdate
#227
pre-commit-ci[bot]
closed
8 months ago
0
Title Change
#226
Sulstice
closed
1 year ago
0
Man Hours Badge Deactivation
#224
jessemillar
closed
4 months ago
0
DK-2: Russian translation of Organophosphorous agents
#223
dhavdc
closed
2 years ago
0
SS-137: Sunbursting SMILES for Chemical Diversity is slow
#222
Sulstice
closed
4 months ago
0
SS-136: GlobalChem Virtual Meetup
#221
Sulstice
closed
4 months ago
3
SS-PR: Reviewing the Surfactant List:
#220
Sulstice
closed
1 year ago
2
SS-135: Cat Genetics
#219
Sulstice
closed
4 months ago
0
Move the Notification System into the Github Actions
#218
Sulstice
closed
2 years ago
0
Public Notification System: Colour Additive List Changes
#217
Sulstice
closed
2 years ago
1
Colour Additive List Changes
#216
Sulstice
closed
2 years ago
1
Update node_pca_analysis.py
#215
Sulstice
closed
2 years ago
0
Idk how to update the website but did update the file, wonder if there is a bot that does that?
#214
Sulstice
closed
2 years ago
0
Update api.js
#213
Sulstice
closed
2 years ago
1
v1.7.4.0
#212
Sulstice
closed
2 years ago
0
SS-6: Another PR to push from the README for OpenSSF compliance.
#211
Sulstice
closed
2 years ago
0
SS-5: Moving all the code into production, shouldn't have done master.
#210
Sulstice
closed
2 years ago
0
Rename fair_compliance_check to fair_compliance_check.yml
#209
Sulstice
closed
2 years ago
0
SS-3: Update master to get to github action FAIR compliance.
#208
Sulstice
closed
2 years ago
0
SS-134: Any Google Colab Probems? Any permission issues
#207
Sulstice
closed
4 months ago
0
BL-2: List review
#205
LierB
closed
2 years ago
7
review biomass
#204
LierB
closed
2 years ago
0
SS-133: Stage the 1.8.0.0 version for release.
#203
Sulstice
closed
4 months ago
0
BL-2: review education
#202
LierB
closed
2 years ago
1
Chemicals From Biomass PR.
#201
Sulstice
closed
2 years ago
0
Production
#200
Sulstice
closed
2 years ago
0
Production-1: Major changes to the PCA analysis for robustness.
#199
Sulstice
closed
2 years ago
0
HW-1: Potential Edit for chemextensions function PCAAnalysis()
#197
hainswor
closed
2 years ago
10
BL-1: pull origin master
#196
LierB
closed
2 years ago
2
Introduction: Changes and Comments
#195
Sulstice
closed
2 years ago
4
SS-132: [GlobalChemExtensions] Write tests for Development Operations for making sure the heartbeat monitors work.
#194
Sulstice
closed
1 year ago
2
SS-130: [GlobalChemExtensions] Write tests for visualizing the orbital files. Maybe there is a save image function we can use for testing.
#193
Sulstice
closed
1 year ago
2
SS-129: [GlobalChemExtensions] Test the extraction of frequency values from an output file provided in the example data.
#192
Sulstice
closed
1 year ago
2
SS-128: [GlobalChemExtensions] Test moly across different cubeprop files.
#191
Sulstice
closed
1 year ago
2
SS-127: [GlobalChemExtensions] The generation of HOMO/LUMO cube psi4 files needs to be tested because moly can't render them.
#190
Sulstice
closed
1 year ago
2
SS-126: [GlobalChemExtensions] Psi4 parsing needs testing in extracting energy values of interest.
#189
Sulstice
closed
1 year ago
2
SS-125: [GlobalChemExtensions] The Z-Matrices in the Z-Matrix store need to be retested and defined in accordance to our own internal standard
#188
Sulstice
closed
1 year ago
2
SS-124: [GlobalChemExtensions] The Scaffold graph adapter needs a pytest.
#187
Sulstice
closed
1 year ago
2
SS-123: [GlobalChemExtensions] Peptides and unusual Peptides need to be tested for robustness of the algorithm in generating stable SMILES strings.
#186
Sulstice
closed
1 year ago
2
SS-122: [GlobalChemExtensions] A test needs to be written to the conversion of a Global-Chem knowledge graph to Networkx
#185
Sulstice
closed
1 year ago
2
SS-121: [GlobalChemExtensions] The principal component analysis just needs verification that it works.
#184
Sulstice
closed
1 year ago
2
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