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Spark, DeepLearning and
Life Sciences, Systems
Biology in the Big Data Age
Dev Lakhani
Overview of Apache Spark
Applications to Sequencing
Applications to Protein Interactions using Deep Learning
Protein Folding
Using GraphX for Ontology Mining
Dev Lakhani
https://uk.linkedin.com/in/devlakhani​
Www.batchinsights.com​
Dl@batchinsights.com
About Me
• I am founder of Batch Insights, a Big Data consultancy that has
worked on numerous Big Data architectures and data science
projects in Tier 1 banking, global telecoms, retail, media and
fashion.
• I have been actively working with the Spark infrastructure since
it's inception and is currently working on various Spark
deployments
• My background is in Software Engineering with Computational
Biology & Statistics from Oxford.
Life: The Original Big Data Problem
564,831 Protein Interactions
569,832 Curated Proteins
54,540,851 Computationally
Hyptohesised proteins
28645 miRNA entries
source: EBI, miRBase
• Distributed Processing Platform
• In-memory processing
• In built frameworks for Machine Learning
• Out built frameworks for Deep Learning
• Broadcast Capability
• Graph Libraries
• Text Processing
• Resilient Distributed Datasets (RDDs)
Spark - Data Processing at Scale
Spark - Parallel Read Mapping
Haas, Brian J,Zody, Michael
C,Advancing RNA-Seq
analysis,Nat
Biotech,2010/05//print,28,5,4
21,423,Nature Publishing
Group,1087-0156
Spark - Parallel Read Mapping
val broadcastGenome = sc.broadcast (Reference Genome)
On worker node
val MappedReads= textFile.flatMap
.map(reads => reads.matchwith(broadcastGenome ))
Spark - Project Tungsten
Java is not the best for String Matching
String objects are "large"
GC pauses and tuning.
Make use of Unsafe - UTF8Strings
C style direct memory access - of heap
Spark - Protein/miRNA Interactions
?
© 2015 David Goodsell
& RCSB Protein Data
Bank
Spark - Representation of Interactions
Interactor A
RPKM
Interactor B
RPKM
Target A
RPKM
10,010,100 18272 129192
9,000,000 20219 1210
2019 122 11
328289 83232 232323222
34243 2333 ?????
(RPKM stands for Reads Per Kilobase of transcript per Million mapped reads.)
Apply Deep Learning
http://tensorflow.org/tutorials/mnist/beginners/index.md
Apply Deep Learning -At Scale
Spark - Protein Folding
http://www.chemistry.emory.
edu/faculty/dyer/protein.php
http://www.lanl.gov/bmsi/Individual%20Research/Werner/foldwide4by7.png
Spark - Parallel Landscape
val count = spark.parallelize(1 to NUM_SAMPLES).map{i =>
val x = Math.random()
val y = Math.random()
if (x*x + y*y < 1) 1 else 0
}.reduce(_ + _)
println("Pi is roughly " + 4.0 * count / NUM_SAMPLES)
val count = spark.parallelize(1 to NUM_SAMPLES).map{i =>
val x = Math.random()
val y = Math.random()
val z = Math.random()
evaluate MFE (Minimum Free Energy)
}.reduce(_ + _)
Spark - Ontology Mining
source: EBI, miRBase
Mining the ontology
Over-represented terms in experiments
Neighborhood analysis - which terms appear together
Phenotype inference using triangle counting
Fast lookup of relationships between terms
Use Scale Free analysis to find hubs in the nodes to find drug targets
Error and attack tolerance of
complex networks
Réka Albert, Hawoong Jeong
and Albert-László Barabási
Nature 406, 378-382(27 July
2000)
doi:10.1038/35019019
Spark - Ontology Mining
http://geneontology.org/
Spark - Other Use Cases
Virtual Drug Screening
Genome Wide Association Studies
Disease Modeling
Environmental Phenotype analysis.
And so on ...
..
…
….
….....
........... https://homes.cs.washington.
edu/~suinlee/research.html
Summary
Intro to Apache Spark
Use scale out computing and broadcast variables to distribute
DNA/RNA Sequence Analysis
Use Machine and Deep Learning to infer network structure
Use brute force landscape modeling for protein folding
Leverage graph libraries for ontology mining
Questions?
Icon made by Appzgear from "http://www.flaticon.com" is licensed under CC BY 3.0
<div>Icon made by <a href="http://www.freepik.com" title="Freepik">Freepik</a> from <a href="http://www.flaticon.com" title="Flaticon">www.flaticon.com</a> is licensed under <a
href="http://creativecommons.org/licenses/by/3.0/" title="Creative Commons BY 3.0">CC BY 3.0</a></div>
"TensorFlow, the TensorFlow logo and any related marks are trademarks of Google Inc."
All trademarks acknowledged

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"Spark, Deep Learning and Life Sciences, Systems Biology in the Big Data Age", Dev Lakhani, Founder of Batch Insights

  • 1. Spark, DeepLearning and Life Sciences, Systems Biology in the Big Data Age Dev Lakhani
  • 2. Overview of Apache Spark Applications to Sequencing Applications to Protein Interactions using Deep Learning Protein Folding Using GraphX for Ontology Mining Dev Lakhani https://uk.linkedin.com/in/devlakhani​ Www.batchinsights.com​ Dl@batchinsights.com
  • 3. About Me • I am founder of Batch Insights, a Big Data consultancy that has worked on numerous Big Data architectures and data science projects in Tier 1 banking, global telecoms, retail, media and fashion. • I have been actively working with the Spark infrastructure since it's inception and is currently working on various Spark deployments • My background is in Software Engineering with Computational Biology & Statistics from Oxford.
  • 4. Life: The Original Big Data Problem 564,831 Protein Interactions 569,832 Curated Proteins 54,540,851 Computationally Hyptohesised proteins 28645 miRNA entries source: EBI, miRBase
  • 5. • Distributed Processing Platform • In-memory processing • In built frameworks for Machine Learning • Out built frameworks for Deep Learning • Broadcast Capability • Graph Libraries • Text Processing • Resilient Distributed Datasets (RDDs) Spark - Data Processing at Scale
  • 6. Spark - Parallel Read Mapping Haas, Brian J,Zody, Michael C,Advancing RNA-Seq analysis,Nat Biotech,2010/05//print,28,5,4 21,423,Nature Publishing Group,1087-0156
  • 7. Spark - Parallel Read Mapping val broadcastGenome = sc.broadcast (Reference Genome) On worker node val MappedReads= textFile.flatMap .map(reads => reads.matchwith(broadcastGenome ))
  • 8. Spark - Project Tungsten Java is not the best for String Matching String objects are "large" GC pauses and tuning. Make use of Unsafe - UTF8Strings C style direct memory access - of heap
  • 9. Spark - Protein/miRNA Interactions ? © 2015 David Goodsell & RCSB Protein Data Bank
  • 10. Spark - Representation of Interactions Interactor A RPKM Interactor B RPKM Target A RPKM 10,010,100 18272 129192 9,000,000 20219 1210 2019 122 11 328289 83232 232323222 34243 2333 ????? (RPKM stands for Reads Per Kilobase of transcript per Million mapped reads.)
  • 12. Apply Deep Learning -At Scale
  • 13. Spark - Protein Folding http://www.chemistry.emory. edu/faculty/dyer/protein.php http://www.lanl.gov/bmsi/Individual%20Research/Werner/foldwide4by7.png
  • 14. Spark - Parallel Landscape val count = spark.parallelize(1 to NUM_SAMPLES).map{i => val x = Math.random() val y = Math.random() if (x*x + y*y < 1) 1 else 0 }.reduce(_ + _) println("Pi is roughly " + 4.0 * count / NUM_SAMPLES) val count = spark.parallelize(1 to NUM_SAMPLES).map{i => val x = Math.random() val y = Math.random() val z = Math.random() evaluate MFE (Minimum Free Energy) }.reduce(_ + _)
  • 15. Spark - Ontology Mining source: EBI, miRBase
  • 16. Mining the ontology Over-represented terms in experiments Neighborhood analysis - which terms appear together Phenotype inference using triangle counting Fast lookup of relationships between terms Use Scale Free analysis to find hubs in the nodes to find drug targets Error and attack tolerance of complex networks Réka Albert, Hawoong Jeong and Albert-László Barabási Nature 406, 378-382(27 July 2000) doi:10.1038/35019019
  • 17. Spark - Ontology Mining http://geneontology.org/
  • 18. Spark - Other Use Cases Virtual Drug Screening Genome Wide Association Studies Disease Modeling Environmental Phenotype analysis. And so on ... .. … …. …..... ........... https://homes.cs.washington. edu/~suinlee/research.html
  • 19. Summary Intro to Apache Spark Use scale out computing and broadcast variables to distribute DNA/RNA Sequence Analysis Use Machine and Deep Learning to infer network structure Use brute force landscape modeling for protein folding Leverage graph libraries for ontology mining Questions? Icon made by Appzgear from "http://www.flaticon.com" is licensed under CC BY 3.0 <div>Icon made by <a href="http://www.freepik.com" title="Freepik">Freepik</a> from <a href="http://www.flaticon.com" title="Flaticon">www.flaticon.com</a> is licensed under <a href="http://creativecommons.org/licenses/by/3.0/" title="Creative Commons BY 3.0">CC BY 3.0</a></div> "TensorFlow, the TensorFlow logo and any related marks are trademarks of Google Inc." All trademarks acknowledged