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Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM Chicago August 3 rd , 2016 Neal S. Grantham, North Carolina State University 1

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Page 1: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Deep Spatial Learning for Forensic Geolocation with Microbiome DataNeal S. GranthamNorth Carolina State University

JSM ChicagoAugust 3rd, 2016

Neal S. Grantham, North Carolina State University 1

Page 2: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Joint work with

☞ Brian Reich (NCSU Statistics)

☞ Eric Laber (NCSU Statistics)

In collaboration with

☞ Rob Dunn (NCSU Biology)

Neal S. Grantham, North Carolina State University 2

Page 3: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

What is a microbiome?

Community of microbial organisms occupying an ecological niche.

Next-generation sequencing technologies make possible efficient identification of these microbes at affordable cost1.

Huge interest in understanding microbiomes as they relate to human health, diet, agriculture, environment, forensics, etc.

1 Metzker. (2010) Sequencing technologies—the next generation. Nature Reviews Genetics.

Neal S. Grantham, North Carolina State University 3

Page 4: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

The White House Launches the National Microbiome Initiative2

Half a billion dollars pledged, with three major goals:

☞ collaboration,

☞ developing better tools for studying microbiomes, and

☞ recruitment.

2 The Atlantic article by Ed Yong, photo by Jim Young / Reuters

Neal S. Grantham, North Carolina State University 4

Page 5: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Statistical challenges

Microbiome data are...

☞ high-dimensional,

☞ sparse,

☞ over-dispersed, and

☞ possess complex dependence structure.

Many exciting opportunities for research with microbiologists.

Neal S. Grantham, North Carolina State University 5

Page 6: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Motivating dataset

Wild Life of Our Homes, a public science project by Rob Dunn Lab.

☞ Dust samples collected from outer door frames of

homes across the continental U.S.

☞ DNA sequencing revealed fungi species3.

3 Well, operational taxonomic units (OTUs) to be precise.

Neal S. Grantham, North Carolina State University 6

Page 7: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Research question:

Does the microbiome composition of an ambient dust sample inform its geographic origin?

Neal S. Grantham, North Carolina State University 7

Page 8: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Our approach:

Build a model to estimate the unknown origin of a dust sample conditional on its known microbiome composition .

Neal S. Grantham, North Carolina State University 8

Page 9: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Initial model and direction

Naive Bayes discriminant analysis estimates origin of dust samples with a median prediction error of 230 kilometers4.

Here, we develop a new model based on

➀ spatial point pattern theory, and

➁ deep learning.

4 Grantham et al. (2015) Fungi identify the geographic origin of dust samples. PLOS One.

Neal S. Grantham, North Carolina State University 9

Page 10: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

1. Spatial point pattern theory

Assume a spatial point pattern5 intensity surface has non-homogeneous Poisson process likelihood

May select a parametric model for .

5 Gelfand et al. (2010) Handbook of Spatial Statistics. CRC Press.

Neal S. Grantham, North Carolina State University 10

Page 11: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

1. Spatial point pattern theory

Liang et al.6 propose a log Gaussian process (GP),

with , a population offset, and unknown.

However, no closed-form solution to integral in .

6 Liang et al. (2008) Analysis of Minnesota colon and rectum cancer point patterns with spatial and nonspatial covariate information. The Annals of Applied Statistics.

Neal S. Grantham, North Carolina State University 11

Page 12: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

1. Spatial point pattern theory

Numerical approximation possible with a Monte Carlo algorithm using a knot-based predictive process6.

Effective, but difficult to implement in practice:

☞ Requires careful knot construction.

☞ Performance suffers for large , larger .

6 Liang et al. (2008) Analysis of Minnesota colon and rectum cancer point patterns with spatial and nonspatial covariate information. The Annals of Applied Statistics.

Neal S. Grantham, North Carolina State University 12

Page 13: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

2. Deep learning

Well-suited for high-dimensional data with complex structure7.

Rich, GPU-enabled software libraries available:

☞ Theano (Python)

☞ Torch7 (Lua)

☞ Tensorflow (C++)

7 LeCun et al. (2015) Deep learning. Nature.

Neal S. Grantham, North Carolina State University 13

Page 14: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

2. Deep learning

Let denote a partition of spatial domain .

Represent every by the region to which it belongs.

Two major benefits:

☞ Avoids costly approximation of integral in .

☞ Reframes estimation as a supervised classification problem.

Neal S. Grantham, North Carolina State University 14

Page 15: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

2. Deep learning

For regions

Estimate by training a deep neural network (DNN) on with categorical cross-entropy cost function

Neal S. Grantham, North Carolina State University 15

Page 16: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Our "Deep Space" algorithm

➀ Generate random Voronoi partition over .

➁ Train DNN on available data from these regions.

➂ Repeat steps 1 & 2 times to develop a diverse collection, , of trained DNNs.

➃ Predict most likely origin by averaging over DNNs in .

Neal S. Grantham, North Carolina State University 16

Page 17: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

1. Generate random Voronoi partition over .

Neal S. Grantham, North Carolina State University 17

Page 18: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

Neal S. Grantham, North Carolina State University 18

Page 19: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

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Page 20: Deep Spatial Learning for Forensic ... - Neal Grantham · Deep Spatial Learning for Forensic Geolocation with Microbiome Data Neal S. Grantham North Carolina State University JSM

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2. Train DNN on available data from these regions.

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3. Repeat steps 1 & 2 times to develop a diverse collection, , of trained DNNs.

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4. Predict most likely origin by averaging over DNNs in .

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Geolocation

A sample with microbiome is most likely to have originated from

where is the geolocation function given by

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96.49 km

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More test sample predictions...

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92.03 km

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53.41 km

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6.58 km

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116.19 km

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Prediction errors

0

10

20

30

40

0 500 1000 1500 2000 2500Kilometers

Count

Min. 1st Qu. Median Mean 3rd Qu. Max. 1.751 53.990 114.700 230.000 245.500 2394.000

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Further work

Develop hypothesis testing framework to test if a sample originates from a particular county, state, etc.

Which fungi are most endemic to different biogeographies? Inference in deep learning is an active area of research.

New applications? The algorithm is not restricted to these data.

Python module deepspace to be made available at github.com/nsgrantham/deepspace upon publication.

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Thank You! Questions?Slides available at nsgrantham.github.io/documents/jsm-2016.pdf

Contact me:

☞ Website: nsgrantham.github.io

☞ Github: github.com/nsgrantham

☞ Twitter: twitter.com/nsgrantham

Neal S. Grantham, North Carolina State University 57