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© 2023 MJBiz, a division of Emerald X, LLC
Simulations of Test Reduction Using Pooled
Heavy Metals Analysis in Cannabis
Dr. Markus Roggen
President/CSO
Delic Labs
© 2023 MJBiz, a division of Emerald X, LLC
Harder, Better, Faster, Stronger
• Why more testing will benefit everyone
• We even make an business case
• How to design pooled test batches to save time and
money
• We are back with more math!
© 2023 MJBiz, a division of Emerald X, LLC
Harder, Better, Faster, Stronger
• Why more testing will benefit everyone
• We even make an business case
• How to design pooled test batches to save time and
money
• We are back with more math!
• Why do you invite me back?
© 2023 MJBiz, a division of Emerald X, LLC
Cannabis Testing
More than just Safety
How to save money with more testing
© 2023 MJBiz, a division of Emerald X, LLC
The Economics of Testing
• Testing is expensive (~$550)
• Failed batches are more expensive (~$1300/lbs)
• CoT = Sample + Test + Failed Batches
• CoG = Production + Testing + Waste
https://doi.org/10.1371/journal.pone.0232041
© 2023 MJBiz, a division of Emerald X, LLC
The Economics of Testing
• How to reduce product failure?
• And keep testing costs low for producers?
• And still make a profit as a testing lab?
© 2023 MJBiz, a division of Emerald X, LLC
The Economics of Testing
• Test more and smaller batches!
• Test before and after process steps!
• Establish HACCP!
• Make the testing cheap for producers, as they are
not compliant test!
https://doi.org/10.5740/jaoacint.18-0205
© 2023 MJBiz, a division of Emerald X, LLC
Define the Problem
• Extractor suffers from contaminated raw material
• Cannabis bioaccumulates heavy metals
• Heavy metal testing is mandated
• Late detection = loss / cross-contamination
• Test early / often = $$$
© 2023 MJBiz, a division of Emerald X, LLC
Pooled Testing to the Rescue?
And who are you to tell me to test more?
© 2023 MJBiz, a division of Emerald X, LLC
Delic Labs and Collaborators
• Health Canada License for Cannabis and
Psychedelic Research
• Process Chemistry
• Analytical Chemistry
• Data Science
• Computational Chemistry
• Not a Testing Lab!
© 2023 MJBiz, a division of Emerald X, LLC
Delic Labs and Collaborators
• Medicine Creek Analytics, WA
• Dr. Amber Wise
• Infinite Chemical Analysis Labs, CA
• Dr. Josh Swider
© 2023 MJBiz, a division of Emerald X, LLC
Pooled Testing in the News
• How to test large number of people for a new virus?
• 133,816 patient samples / ~30,000 tests
• 20x more test for same budget https://doi.org/10.1126/scitranslmed.abf1568
© 2023 MJBiz, a division of Emerald X, LLC
• How to test large number of people for a new virus?
• 133,816 patient samples / ~30,000 tests
• 20x more test for same budget
Pooled Testing in the News
https://doi.org/10.1126/scitranslmed.abf1568
© 2023 MJBiz, a division of Emerald X, LLC
Quantitative Pooled Testing
https://doi.org/10.1097/QAI.0b013e3181ba37a7
© 2023 MJBiz, a division of Emerald X, LLC
Quantitative Pooled Testing
• Pooling used to reduce costs of polymerase chain
reaction-based screening for acute HIV infection
• Variety of pooling strategies for prevalence of HIV
1% - 25%
https://doi.org/10.1097/QAI.0b013e3181ba37a7
© 2023 MJBiz, a division of Emerald X, LLC
Quantitative Pooled Testing
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: ~10%
• Tests: 25
© 2023 MJBiz, a division of Emerald X, LLC
Quantitative Pooled Testing: Minipool
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: ~10%
• Test whole
row
• If threshold
≥1.8, look
for failed
sample
• Tests: 5
© 2023 MJBiz, a division of Emerald X, LLC
1.9
2.0
0.9
1.5
1.0
Quantitative Pooled Testing: Minipool
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: ~10%
• Test whole
row
• If threshold
≥1.8, look
for failed
sample
• Tests: 5
© 2023 MJBiz, a division of Emerald X, LLC
n/a
1.4
0.9
1.5
1.0
Quantitative Pooled Testing: Minipool
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: 8%
• Test indiv.
samples of
failed row
until avg.
passes
• Tests: 11
• 56% saved
5.0
1.0 1.4 1.3 1.1 5.2
© 2023 MJBiz, a division of Emerald X, LLC
Quantitative Pooled Testing: Matrix
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: ~10%
1.9
2.0
0.9
1.5
1.0
2.1 1.8
1.3
0.8
1.4
• Test row &
column
• If threshold
≥1.8, look
for failed
sample
• Tests: 10
© 2023 MJBiz, a division of Emerald X, LLC 1.5
1.1
Quantitative Pooled Testing: Matrix
Indiv. Samples
• Value: 0-10
• Avg.: 1
• Fail: ≥5
• Fail: 8%
2.2
0.9
1.5
1.0
1.8
1.3
0.8
1.4
• Test row &
column
• If threshold
≥1.8, look
for failed
sample
• Tests: 12
• 52% saved
5.0
1.0
© 2023 MJBiz, a division of Emerald X, LLC
What is Pooled Testing of Heavy Metals!?
© 2023 MJBiz, a division of Emerald X, LLC
What is Pooled Testing of Heavy Metals!?
Psycho
Las Vegas
2019
© 2023 MJBiz, a division of Emerald X, LLC
What is Pooled Testing of Heavy Metals!?
Herman Li
Dragonforce
© 2023 MJBiz, a division of Emerald X, LLC
© 2023 MJBiz, a division of Emerald X, LLC
Define the Goal
• Increase sample throughput in cannabis testing labs
• Reduce strain on the industry
• Increase product safety
• Safe costs
• Demonstrate that pooling
strategies works
© 2023 MJBiz, a division of Emerald X, LLC
Today’s Goal
• Present an algorithm to simulate different pooling
strategies
• Apply to real world data sets of Washington and
California state testing labs
© 2023 MJBiz, a division of Emerald X, LLC
The Datasets: Only Flower
© 2023 MJBiz, a division of Emerald X, LLC
The Datasets: Only Flower
13% 20% 1.4%
© 2023 MJBiz, a division of Emerald X, LLC
The Datasets
• Bootstrap sampling
• Synthetic data to
simulate pooling
strategies
© 2023 MJBiz, a division of Emerald X, LLC
Sampling Strategies
• Each sample contains a value V between 0 and ∞
• For each heavy metal
• Fail value of K
• If V ≥ K the sample is considered contaminated
• 8,000,000 sample simulations later…
© 2023 MJBiz, a division of Emerald X, LLC
Results
It depends:
• State
• Metals
• Pool strategy
• LOD
• LLOQ
© 2023 MJBiz, a division of Emerald X, LLC
Results
It depends:
• State
• Metals
• Pool strategy
• LOD
• LLOQ
© 2023 MJBiz, a division of Emerald X, LLC
Fine Print
Measurement at the part-per-trillion scale requires extremely sensitive
instrumentation which is susceptible to cross-contamination. Therefore,
cross-contamination is also a concern for this analysis given the low
detection limits available with ICP-MS. Those who wish to validate this
method will need to be vigilant in taking preventative measures to
minimize contamination throughout the laboratory. Appropriate lab
separations and designated instruments and equipment should be utilized
to minimize cross-contamination.
As acknowledged by Cleary et al., pooling samples adds a level of
complexity in the lab because samples would need to be tracked across
multiple pools. To overcome this, testing labs might employ effective
tracking software or other methods.
© 2023 MJBiz, a division of Emerald X, LLC
Pooled Testing Conclusion
• 3 sample pool = 23.8% less tests (WA)
• 4 sample pool = 54.1% less tests (CA)
• Developed case-by-case to reduce time, effort, cost
© 2023 MJBiz, a division of Emerald X, LLC
Pooled Testing Conclusion
• Benefits vary depending on region / contamination
• Overall
• Reduced fiscal costs
• Increased efficiency
• Increased testing
• Greater safety
© 2023 MJBiz, a division of Emerald X, LLC
Try it out!
• Use in your lab
• Use for large customers
• Specific to one input type
• Should work for any test type: Pesticides, Bio,
Toxins
• We help with implementation!
© 2023 MJBiz, a division of Emerald X, LLC
Links
• https://doi.org/10.1093/jaoacint/qsac140
• https://github.com/cbdv-
ltd/pooled_testing_simulations
© 2023 MJBiz, a division of Emerald X, LLC
• Pool Testing
• Cost Saving
• Heavy Metal
• Markus doesn’t
know music
• Questions?
markus@deliclabs.com
www.deliclabs.com

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Simulations of Test Reduction Using Pooled Heavy Metals Analysis in Cannabis

  • 1. © 2023 MJBiz, a division of Emerald X, LLC Simulations of Test Reduction Using Pooled Heavy Metals Analysis in Cannabis Dr. Markus Roggen President/CSO Delic Labs
  • 2. © 2023 MJBiz, a division of Emerald X, LLC Harder, Better, Faster, Stronger • Why more testing will benefit everyone • We even make an business case • How to design pooled test batches to save time and money • We are back with more math!
  • 3. © 2023 MJBiz, a division of Emerald X, LLC Harder, Better, Faster, Stronger • Why more testing will benefit everyone • We even make an business case • How to design pooled test batches to save time and money • We are back with more math! • Why do you invite me back?
  • 4. © 2023 MJBiz, a division of Emerald X, LLC Cannabis Testing More than just Safety How to save money with more testing
  • 5. © 2023 MJBiz, a division of Emerald X, LLC The Economics of Testing • Testing is expensive (~$550) • Failed batches are more expensive (~$1300/lbs) • CoT = Sample + Test + Failed Batches • CoG = Production + Testing + Waste https://doi.org/10.1371/journal.pone.0232041
  • 6. © 2023 MJBiz, a division of Emerald X, LLC The Economics of Testing • How to reduce product failure? • And keep testing costs low for producers? • And still make a profit as a testing lab?
  • 7. © 2023 MJBiz, a division of Emerald X, LLC The Economics of Testing • Test more and smaller batches! • Test before and after process steps! • Establish HACCP! • Make the testing cheap for producers, as they are not compliant test! https://doi.org/10.5740/jaoacint.18-0205
  • 8. © 2023 MJBiz, a division of Emerald X, LLC Define the Problem • Extractor suffers from contaminated raw material • Cannabis bioaccumulates heavy metals • Heavy metal testing is mandated • Late detection = loss / cross-contamination • Test early / often = $$$
  • 9. © 2023 MJBiz, a division of Emerald X, LLC Pooled Testing to the Rescue? And who are you to tell me to test more?
  • 10. © 2023 MJBiz, a division of Emerald X, LLC Delic Labs and Collaborators • Health Canada License for Cannabis and Psychedelic Research • Process Chemistry • Analytical Chemistry • Data Science • Computational Chemistry • Not a Testing Lab!
  • 11. © 2023 MJBiz, a division of Emerald X, LLC Delic Labs and Collaborators • Medicine Creek Analytics, WA • Dr. Amber Wise • Infinite Chemical Analysis Labs, CA • Dr. Josh Swider
  • 12. © 2023 MJBiz, a division of Emerald X, LLC Pooled Testing in the News • How to test large number of people for a new virus? • 133,816 patient samples / ~30,000 tests • 20x more test for same budget https://doi.org/10.1126/scitranslmed.abf1568
  • 13. © 2023 MJBiz, a division of Emerald X, LLC • How to test large number of people for a new virus? • 133,816 patient samples / ~30,000 tests • 20x more test for same budget Pooled Testing in the News https://doi.org/10.1126/scitranslmed.abf1568
  • 14. © 2023 MJBiz, a division of Emerald X, LLC Quantitative Pooled Testing https://doi.org/10.1097/QAI.0b013e3181ba37a7
  • 15. © 2023 MJBiz, a division of Emerald X, LLC Quantitative Pooled Testing • Pooling used to reduce costs of polymerase chain reaction-based screening for acute HIV infection • Variety of pooling strategies for prevalence of HIV 1% - 25% https://doi.org/10.1097/QAI.0b013e3181ba37a7
  • 16. © 2023 MJBiz, a division of Emerald X, LLC Quantitative Pooled Testing Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: ~10% • Tests: 25
  • 17. © 2023 MJBiz, a division of Emerald X, LLC Quantitative Pooled Testing: Minipool Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: ~10% • Test whole row • If threshold ≥1.8, look for failed sample • Tests: 5
  • 18. © 2023 MJBiz, a division of Emerald X, LLC 1.9 2.0 0.9 1.5 1.0 Quantitative Pooled Testing: Minipool Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: ~10% • Test whole row • If threshold ≥1.8, look for failed sample • Tests: 5
  • 19. © 2023 MJBiz, a division of Emerald X, LLC n/a 1.4 0.9 1.5 1.0 Quantitative Pooled Testing: Minipool Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: 8% • Test indiv. samples of failed row until avg. passes • Tests: 11 • 56% saved 5.0 1.0 1.4 1.3 1.1 5.2
  • 20. © 2023 MJBiz, a division of Emerald X, LLC Quantitative Pooled Testing: Matrix Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: ~10% 1.9 2.0 0.9 1.5 1.0 2.1 1.8 1.3 0.8 1.4 • Test row & column • If threshold ≥1.8, look for failed sample • Tests: 10
  • 21. © 2023 MJBiz, a division of Emerald X, LLC 1.5 1.1 Quantitative Pooled Testing: Matrix Indiv. Samples • Value: 0-10 • Avg.: 1 • Fail: ≥5 • Fail: 8% 2.2 0.9 1.5 1.0 1.8 1.3 0.8 1.4 • Test row & column • If threshold ≥1.8, look for failed sample • Tests: 12 • 52% saved 5.0 1.0
  • 22. © 2023 MJBiz, a division of Emerald X, LLC What is Pooled Testing of Heavy Metals!?
  • 23. © 2023 MJBiz, a division of Emerald X, LLC What is Pooled Testing of Heavy Metals!? Psycho Las Vegas 2019
  • 24. © 2023 MJBiz, a division of Emerald X, LLC What is Pooled Testing of Heavy Metals!? Herman Li Dragonforce
  • 25. © 2023 MJBiz, a division of Emerald X, LLC
  • 26. © 2023 MJBiz, a division of Emerald X, LLC Define the Goal • Increase sample throughput in cannabis testing labs • Reduce strain on the industry • Increase product safety • Safe costs • Demonstrate that pooling strategies works
  • 27. © 2023 MJBiz, a division of Emerald X, LLC Today’s Goal • Present an algorithm to simulate different pooling strategies • Apply to real world data sets of Washington and California state testing labs
  • 28. © 2023 MJBiz, a division of Emerald X, LLC The Datasets: Only Flower
  • 29. © 2023 MJBiz, a division of Emerald X, LLC The Datasets: Only Flower 13% 20% 1.4%
  • 30. © 2023 MJBiz, a division of Emerald X, LLC The Datasets • Bootstrap sampling • Synthetic data to simulate pooling strategies
  • 31. © 2023 MJBiz, a division of Emerald X, LLC Sampling Strategies • Each sample contains a value V between 0 and ∞ • For each heavy metal • Fail value of K • If V ≥ K the sample is considered contaminated • 8,000,000 sample simulations later…
  • 32. © 2023 MJBiz, a division of Emerald X, LLC Results It depends: • State • Metals • Pool strategy • LOD • LLOQ
  • 33. © 2023 MJBiz, a division of Emerald X, LLC Results It depends: • State • Metals • Pool strategy • LOD • LLOQ
  • 34. © 2023 MJBiz, a division of Emerald X, LLC Fine Print Measurement at the part-per-trillion scale requires extremely sensitive instrumentation which is susceptible to cross-contamination. Therefore, cross-contamination is also a concern for this analysis given the low detection limits available with ICP-MS. Those who wish to validate this method will need to be vigilant in taking preventative measures to minimize contamination throughout the laboratory. Appropriate lab separations and designated instruments and equipment should be utilized to minimize cross-contamination. As acknowledged by Cleary et al., pooling samples adds a level of complexity in the lab because samples would need to be tracked across multiple pools. To overcome this, testing labs might employ effective tracking software or other methods.
  • 35. © 2023 MJBiz, a division of Emerald X, LLC Pooled Testing Conclusion • 3 sample pool = 23.8% less tests (WA) • 4 sample pool = 54.1% less tests (CA) • Developed case-by-case to reduce time, effort, cost
  • 36. © 2023 MJBiz, a division of Emerald X, LLC Pooled Testing Conclusion • Benefits vary depending on region / contamination • Overall • Reduced fiscal costs • Increased efficiency • Increased testing • Greater safety
  • 37. © 2023 MJBiz, a division of Emerald X, LLC Try it out! • Use in your lab • Use for large customers • Specific to one input type • Should work for any test type: Pesticides, Bio, Toxins • We help with implementation!
  • 38. © 2023 MJBiz, a division of Emerald X, LLC Links • https://doi.org/10.1093/jaoacint/qsac140 • https://github.com/cbdv- ltd/pooled_testing_simulations
  • 39. © 2023 MJBiz, a division of Emerald X, LLC • Pool Testing • Cost Saving • Heavy Metal • Markus doesn’t know music • Questions? markus@deliclabs.com www.deliclabs.com