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Nimrita Koul
Research Scholar
School of Computing & Information Technology,
REVA University, Bangalore
Bioinformatics
1
Bio - Informatics
Definition- The research, development and application of
computational tools for analysis, modelling, and simulation of
biological data.
i.e. To Investigate questions about biological composition, structure, function,
and evolution of molecules, cells, tissues, and organisms using mathematics,
informatics, statistics and computer science.
Synonyms – Genomic Data Science, Computational Biology, Computational
Genomics, Statistical Genomics
2
3
An Interdisciplinary Field
Image Courtesy – www.researchgate.com
The Work Ground of Bioinformatics
Image Credit - https://openoregon.pressbooks.pub/mhccmajorsbio/chapter/dna-organization-inside-a-cell/
The flow of information from DNA to RNA to protein in a cell.
Image Credit – www.nature.com
Central Dogma of Molecular Biology
The Bioinformatics Cycle
DNA/ RNA Structure as Context Free
Grammar
• The problem of describing RNA structure can be modelled as a context free grammar.
This structure is determined by attraction between nucleotides – A(adenine) attracts
U(uracil), C(Cytosine) attracts G(Guanine). Writing this as a CFG rule –
S  aSu | uSa | ε
will generate palindrome like sequences of u’s and a’s of even length.
This grammar becomes increasingly complex as we incorporate other biological
components of a cell into it. Eg.
S → aSu/uSa/N N→aN/uN/ε
S → SS
S → cSg/gSc/
N →aN/uN/cN/gN/Na/Nu/Nc/Ng/ε
Bioinformatics Flow Chart
1a. Gene Sequencing
1b. Analysis of nucleic acid sequences
2. Analysis of protein sequences
3. Molecular structure prediction
4. Prediction of Molecular interactions
5. Inference of Metabolic and regulatory networks
6. Gene & Protein expression data
7. Drug screening
Ab initio drug design OR Drug
compound screening in database of
molecules
8. Genetic variability
Protein Sequence and Structures Repositories
Protein Sequence and Structure Databases
Gene Expression Databases
Integrated Database Retrieval and Analysis
Systems
Pathways Databases and Platforms
Computational Research Problems in
Bioinformatics –
• 1. Comparison of Long Sequences of nucleotides/amino acids.
• 2. Construction of Evolutionary Phylogenetic Trees to figure similarity in
genetic traits
• 3. Gene Detection in Sequences of amino acids in DNA.
• 4. Determining 3D structures of DNA, RNA and Proteins.
• 5. Reverse Engineering of GRNs - Inferring Cell Regulation
• 6. Assembling DNA Fragments from various sources/machines
• 7. Creation of Ontologies to annotate the various Transcripts and events
• 8. Development of Specialized Scripting Languages for Bioinformatics tasks
Application of Bioinformatics
• Disease Diagnosis and
Prediction
• Antibiotic Resistance
• Waste Cleanup
• Molecular medicine
• Personalized medicine
• Preventative medicine
• Crop improvement
• Forensic analysis
• Bio-weapon creation
• Evolutionary Studies
• Climate change Studies
• Alternative energy
sources
• Improve nutritional
quality of crops
• Development of Drought
resistant crop varieties
• Veterinary Science
• Gene therapy
• Antibiotic resistance
• Insect resistance studies
• Drug Discovery
• Target
Identification
• Target Validation
• Lead Identification
• Lead Optimization
Team work for Computational Cancer Biology
statistician
Molecular Oncologist
( Pathway Analysis)
Pathologist
Oncologist
molecular biologist
mathematician
data scientist
Machine Learning Expert
data bases specialist
User friendly interfaces
IT infrastructure (storage,
updates etc)
Case Studies
Classification of Mental States using EEG Data
Applications - Human – robot interaction, Brain – computer interfacing
Experimental Procedure –
1. Data collection by attaching 4 extra cranial electrodes to head of
subjects (EEG) sensors – the subjects were shown different kinds of
movie clips to evoke different emotional states.
2. Feature Extraction – Through fast Fourier transform and Shannon
Entropy
3. Classification – using CNN, or any conventional classification
algorithm
Parkinson’s Prediction
Shorter bioinformatics
Shorter bioinformatics
Shorter bioinformatics
Shorter bioinformatics

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Shorter bioinformatics

  • 1. Nimrita Koul Research Scholar School of Computing & Information Technology, REVA University, Bangalore Bioinformatics 1
  • 2. Bio - Informatics Definition- The research, development and application of computational tools for analysis, modelling, and simulation of biological data. i.e. To Investigate questions about biological composition, structure, function, and evolution of molecules, cells, tissues, and organisms using mathematics, informatics, statistics and computer science. Synonyms – Genomic Data Science, Computational Biology, Computational Genomics, Statistical Genomics 2
  • 3. 3 An Interdisciplinary Field Image Courtesy – www.researchgate.com
  • 4. The Work Ground of Bioinformatics Image Credit - https://openoregon.pressbooks.pub/mhccmajorsbio/chapter/dna-organization-inside-a-cell/
  • 5. The flow of information from DNA to RNA to protein in a cell. Image Credit – www.nature.com Central Dogma of Molecular Biology
  • 7.
  • 8. DNA/ RNA Structure as Context Free Grammar • The problem of describing RNA structure can be modelled as a context free grammar. This structure is determined by attraction between nucleotides – A(adenine) attracts U(uracil), C(Cytosine) attracts G(Guanine). Writing this as a CFG rule – S  aSu | uSa | ε will generate palindrome like sequences of u’s and a’s of even length. This grammar becomes increasingly complex as we incorporate other biological components of a cell into it. Eg. S → aSu/uSa/N N→aN/uN/ε S → SS S → cSg/gSc/ N →aN/uN/cN/gN/Na/Nu/Nc/Ng/ε
  • 9. Bioinformatics Flow Chart 1a. Gene Sequencing 1b. Analysis of nucleic acid sequences 2. Analysis of protein sequences 3. Molecular structure prediction 4. Prediction of Molecular interactions 5. Inference of Metabolic and regulatory networks 6. Gene & Protein expression data 7. Drug screening Ab initio drug design OR Drug compound screening in database of molecules 8. Genetic variability
  • 10. Protein Sequence and Structures Repositories
  • 11. Protein Sequence and Structure Databases
  • 13. Integrated Database Retrieval and Analysis Systems
  • 15.
  • 16. Computational Research Problems in Bioinformatics – • 1. Comparison of Long Sequences of nucleotides/amino acids. • 2. Construction of Evolutionary Phylogenetic Trees to figure similarity in genetic traits • 3. Gene Detection in Sequences of amino acids in DNA. • 4. Determining 3D structures of DNA, RNA and Proteins. • 5. Reverse Engineering of GRNs - Inferring Cell Regulation • 6. Assembling DNA Fragments from various sources/machines • 7. Creation of Ontologies to annotate the various Transcripts and events • 8. Development of Specialized Scripting Languages for Bioinformatics tasks
  • 17. Application of Bioinformatics • Disease Diagnosis and Prediction • Antibiotic Resistance • Waste Cleanup • Molecular medicine • Personalized medicine • Preventative medicine • Crop improvement • Forensic analysis • Bio-weapon creation • Evolutionary Studies • Climate change Studies • Alternative energy sources • Improve nutritional quality of crops • Development of Drought resistant crop varieties • Veterinary Science • Gene therapy • Antibiotic resistance • Insect resistance studies • Drug Discovery • Target Identification • Target Validation • Lead Identification • Lead Optimization
  • 18. Team work for Computational Cancer Biology statistician Molecular Oncologist ( Pathway Analysis) Pathologist Oncologist molecular biologist mathematician data scientist Machine Learning Expert data bases specialist User friendly interfaces IT infrastructure (storage, updates etc)
  • 20. Classification of Mental States using EEG Data Applications - Human – robot interaction, Brain – computer interfacing Experimental Procedure – 1. Data collection by attaching 4 extra cranial electrodes to head of subjects (EEG) sensors – the subjects were shown different kinds of movie clips to evoke different emotional states. 2. Feature Extraction – Through fast Fourier transform and Shannon Entropy 3. Classification – using CNN, or any conventional classification algorithm