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Using multivariate statistics to identify
analyte sources in sediments & biota at a
shallow-water, military munitions
disposal site off leeward O‘ahu, Hawai‘i
Michael S. Tomlinson Eric H. De Carlo
Geoffrey L. Carton Dennis R. Helsel
Oʻahu, Hawaiʻi
Oʻahu
Hawaiʻi
Maui
Kauaʻi
Molokaʻi
Lānaʻi
Kahoʻolawe
Niʻihau
Ordnance Reef
Study Area
Diamond Head
HonoluluBarbers
Point
Kaʻena Point
Kahuku Point
Makapuʻu
Point
Kailua
Kāneʻohe
Māmala Bay
Waiʻanae
What is the problem?
Discarded Military
Munitions
or DMM
(conventional)
How extensive is the problem?
The Study
• 141 sediment samples from 4 strata
– DMM (discarded military munitions)
– CON (control)
– NPS (nonpoint source)
– WWT (wastewater treatment)
• 286 biota samples from 4 organism types
– Limu (seaweed)
– He‘e (octopus)
– Weke (fish)
– Pāpaʻi kua loa (Kona crab)
The Study (continued)
• 5 sediment sampling events (different
seasons)
• 4 biota sampling events (different seasons)
• Sediments & biota analyzed for elements &
energetics (propellants & explosives)
• Multiple nondetects
• Multiple detection levels
Nondetects (NDs) are data!
(Partial table below is a good format for biogeochemical data)
The “U” data qualifier inserted by data validator is a confirmation of the lab result,
i.e., “ND”. Note: “ND” provides NO information without the detection limit (DL)
So what do you do with nondetects (NDs)
Ignore
0
½DL
DL
RL
We used some of the
multivariate statistical
techniques described
in
These techniques included:
• Summary statistics using:
– Kaplan-Meier
– Regression on order statistics
• Kendall’s tau nonparametric correlation
• Interval-censored score test (analogous to
generalized Wilcoxon test)
• Nonmetric multidimensional scaling (NMDS)
(discussing today) using interval censored data
We used interval-censored data thereby
avoiding substitution
We applied nonmetric multidimensional
scaling (NMDS) to the interval-censored
data to identify analyte sources
NMDS revealed distinct analyte clusters
Notice how
DMM
analytes (Mg,
Pb, Cu, & Zn
& energetics)
cluster
And, notice
how terrestrial
elements
cluster
(Typically, a Kruskal’s stress ≤ 0.20
indicates pattern is not random)
And, if you overlay the samples…
Most DMM
samples
cluster with
the DMM
analytes
and most
samples
influenced by
terrestrial
processes
cluster with
terrestrial
analytes
And, now something for the biologists –
• NMDS of biota
(Hawaiian food)
• No strong
patterns by
strata, but…
Not surprisingly, data clustered by organism
Cu-based hemocyanin & Cu- & Zn-based enzymes (White & Rainbow, 1985)
Only limu exhibited clustering by strata – Why?
• Biology differs from other organisms?
• Sessile rather than motile organism
Conclusions
 There are a number of multivariate statistical routines that
can work with left-censored data with multiple DLs
 Substitution (e.g., ½DL) is neither necessary nor
recommended
 Nonmetric multidimensional scaling (NMDS) was able to
identify the sources of most analytes in sediment
 Overlaying the NMDS results for sediment samples generally
corroborated the analyte results
 The elements Cu, Zn, Pb & Mg and energetics clustered with
each other and the DMM samples
 Terrestrial elements clustered with samples from the CON,
NPS, and WWT strata
Conclusions (continued)
 NMDS plots of biota (typical Hawaiian food), not surprisingly,
clustered by organism
 Octopus & crabs clustered with each other & with Cu & Zn
o Cu – because the blood of both organisms contain
hemocyanin
o Cu & Zn – because of the high concentrations of Cu & Zn
enzymes found in both organisms
 Only limu kohu or asparagus seaweed (Asparagopsis
taxiformis) showed any clustering by strata – Why?
o Different biology (plant rather than animal)?
o Sessile rather than motile
 Multivariate statistical analyses such as NMDS can aid in the
identification of analyte sources
Acknowledgments
My coauthors
– Eric H. De Carlo (UHM Oceanography)
– Geoffrey L. Carton (CALIBRE Systems)
– Dennis R. Helsel (Practical Stats)
And a special Mahalo
to Mr. Keoki Stender
for allowing me to use
his marine life photos
www.keokiscuba.com/
www.marinelifephotography.com
Mahalo nui loa! Questions?
Michael Tomlinson – mtomlins@hawaii.edu

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Tomlinson et al (2016) - sediment & biota

  • 1. Using multivariate statistics to identify analyte sources in sediments & biota at a shallow-water, military munitions disposal site off leeward O‘ahu, Hawai‘i Michael S. Tomlinson Eric H. De Carlo Geoffrey L. Carton Dennis R. Helsel
  • 2. Oʻahu, Hawaiʻi Oʻahu Hawaiʻi Maui Kauaʻi Molokaʻi Lānaʻi Kahoʻolawe Niʻihau Ordnance Reef Study Area Diamond Head HonoluluBarbers Point Kaʻena Point Kahuku Point Makapuʻu Point Kailua Kāneʻohe Māmala Bay Waiʻanae
  • 3. What is the problem? Discarded Military Munitions or DMM (conventional)
  • 4. How extensive is the problem?
  • 5. The Study • 141 sediment samples from 4 strata – DMM (discarded military munitions) – CON (control) – NPS (nonpoint source) – WWT (wastewater treatment) • 286 biota samples from 4 organism types – Limu (seaweed) – He‘e (octopus) – Weke (fish) – Pāpaʻi kua loa (Kona crab)
  • 6. The Study (continued) • 5 sediment sampling events (different seasons) • 4 biota sampling events (different seasons) • Sediments & biota analyzed for elements & energetics (propellants & explosives) • Multiple nondetects • Multiple detection levels
  • 7. Nondetects (NDs) are data! (Partial table below is a good format for biogeochemical data) The “U” data qualifier inserted by data validator is a confirmation of the lab result, i.e., “ND”. Note: “ND” provides NO information without the detection limit (DL)
  • 8. So what do you do with nondetects (NDs) Ignore 0 ½DL DL RL
  • 9. We used some of the multivariate statistical techniques described in
  • 10. These techniques included: • Summary statistics using: – Kaplan-Meier – Regression on order statistics • Kendall’s tau nonparametric correlation • Interval-censored score test (analogous to generalized Wilcoxon test) • Nonmetric multidimensional scaling (NMDS) (discussing today) using interval censored data
  • 11. We used interval-censored data thereby avoiding substitution
  • 12. We applied nonmetric multidimensional scaling (NMDS) to the interval-censored data to identify analyte sources
  • 13. NMDS revealed distinct analyte clusters Notice how DMM analytes (Mg, Pb, Cu, & Zn & energetics) cluster And, notice how terrestrial elements cluster (Typically, a Kruskal’s stress ≤ 0.20 indicates pattern is not random)
  • 14. And, if you overlay the samples… Most DMM samples cluster with the DMM analytes and most samples influenced by terrestrial processes cluster with terrestrial analytes
  • 15. And, now something for the biologists – • NMDS of biota (Hawaiian food) • No strong patterns by strata, but…
  • 16. Not surprisingly, data clustered by organism Cu-based hemocyanin & Cu- & Zn-based enzymes (White & Rainbow, 1985)
  • 17. Only limu exhibited clustering by strata – Why? • Biology differs from other organisms? • Sessile rather than motile organism
  • 18. Conclusions  There are a number of multivariate statistical routines that can work with left-censored data with multiple DLs  Substitution (e.g., ½DL) is neither necessary nor recommended  Nonmetric multidimensional scaling (NMDS) was able to identify the sources of most analytes in sediment  Overlaying the NMDS results for sediment samples generally corroborated the analyte results  The elements Cu, Zn, Pb & Mg and energetics clustered with each other and the DMM samples  Terrestrial elements clustered with samples from the CON, NPS, and WWT strata
  • 19. Conclusions (continued)  NMDS plots of biota (typical Hawaiian food), not surprisingly, clustered by organism  Octopus & crabs clustered with each other & with Cu & Zn o Cu – because the blood of both organisms contain hemocyanin o Cu & Zn – because of the high concentrations of Cu & Zn enzymes found in both organisms  Only limu kohu or asparagus seaweed (Asparagopsis taxiformis) showed any clustering by strata – Why? o Different biology (plant rather than animal)? o Sessile rather than motile  Multivariate statistical analyses such as NMDS can aid in the identification of analyte sources
  • 20. Acknowledgments My coauthors – Eric H. De Carlo (UHM Oceanography) – Geoffrey L. Carton (CALIBRE Systems) – Dennis R. Helsel (Practical Stats) And a special Mahalo to Mr. Keoki Stender for allowing me to use his marine life photos www.keokiscuba.com/ www.marinelifephotography.com
  • 21. Mahalo nui loa! Questions? Michael Tomlinson – mtomlins@hawaii.edu