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Bioinformatics%20For%20MNW%202nd%20Year

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Jens Kleinjung (1/11/02) Victor Simosis PhD (1/12/02) ... Rembrandt, 1632. Newton, 1726. Mathematics. Statistics. Computer. Science. Informatics. Biology ... – PowerPoint PPT presentation

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Title: Bioinformatics%20For%20MNW%202nd%20Year


1
Bioinformatics For MNW 2nd Year
  • Jaap Heringa
  • FEW/FALW
  • Integrative Bioinformatics Institute VU (IBIVU)
  • heringa_at_cs.vu.nl, www.cs.vu.nl/ibivu, Tel.
    47649, Rm R4.41

2
Current Bioinformatics Unit
  • Jens Kleinjung (1/11/02)
  • Victor Simosis PhD (1/12/02)
  • Radek Szklarczyk - PhD (1/01/03)

3
Bioinformatics course 2nd year MNW spring 2003
  • Pattern recognition
  • Supervised/unsupervised learning
  • Types of data, data normalisation, lacking data
  • Search image
  • Similarity/distance measures
  • Clustering
  • Principal component analysis
  • Discriminant analysis

4
Bioinformatics course 2nd year MNW spring 2003
  • Protein
  • Folding
  • Structure and function
  • Protein structure prediction
  • Secondary structure
  • Tertiary structure
  • Function
  • Post-translational modification
  • Prot.-Prot. Interaction -- Docking algorithm
  • Molecular dynamics/Monte Carlo

5
Bioinformatics course 2nd year MNW spring 2003
  • Sequence analysis
  • Pairwise alignment
  • Dynamic programming (NW, SW, shortcuts)
  • Multiple alignment
  • Combining information
  • Database/homology searching (Fasta, Blast,
    Statistical issues-E/P values)

6
Bioinformatics course 2nd year MNW spring 2003
  • Gene structure and gene finding algorithms
  • Genomics
  • Expression data, Nucleus to ribosome,
    translation, etc.
  • Proteomics, Metabolomics, Physiomics
  • Databases
  • DNA, EST
  • Protein sequence (SwissProt)
  • Protein structure (PDB)
  • Microarray data
  • Proteomics
  • Mass spectrometry/NMR/X-ray

7
Bioinformatics course 2nd year MNW spring 2003
  • Bioinformatics method development
  • Programming and scripting languages
  • Web solutions
  • Computational issues
  • NP-complete problems
  • CPU, memory, storage problems
  • Parallel computing
  • Bioinformatics method usage/application
  • Molecular viewers (RasMol, MolMol, etc.)

8
Gathering knowledge
  • Anatomy, architecture
  • Dynamics, mechanics
  • Informatics
  • (Cybernetics Wiener, 1948)
  • (Cybernetics has been defined as the science of
    control in machines and animals, and hence it
    applies to technological, animal and
    environmental systems)
  • Genomics, bioinformatics

Rembrandt, 1632
Newton, 1726
9
Bioinformatics
Chemistry
Biology Molecular biology
Mathematics Statistics
Bioinformatics
Computer Science Informatics
Medicine
Physics
10
Bioinformatics
  • Studying informational processes in biological
    systems (Hogeweg, early 1970s)
  • No computers necessary
  • Back of envelope OK

Information technology applied to the management
and analysis of biological data (Attwood and
Parry-Smith)
Applying algorithms with mathematical formalisms
in biology (genomics) -- USA
11
Bioinformatics in the olden days
  • Close to Molecular Biology
  • (Statistical) analysis of protein and nucleotide
    structure
  • Protein folding problem
  • Protein-protein and protein-nucleotide
    interaction
  • Many essential methods were created early on (BG
    era)
  • Protein sequence analysis (pairwise and multiple
    alignment)
  • Protein structure prediction (secondary, tertiary
    structure)

12
Bioinformatics in the olden days (Cont.)
  • Evolution was studied and methods created
  • Phylogenetic reconstruction (clustering NJ
    method

13
  • But then the big bang.

14
The Human Genome -- 26 June 2000
15
The Human Genome -- 26 June 2000
Dr. Craig Venter Celera Genomics -- Shotgun method
Sir John Sulston Human Genome Project
16
Human DNA
  • There are about 3bn (3 ? 109) nucleotides in the
    nucleus of almost all of the trillions (3.5 ?
    1012 ) of cells of a human body (an exception is,
    for example, red blood cells which have no
    nucleus and therefore no DNA) a total of 1022
    nucleotides!
  • Many DNA regions code for proteins, and are
    called genes (1 gene codes for 1 protein in
    principle)
  • Human DNA contains 30,000 expressed genes
  • Deoxyribonucleic acid (DNA) comprises 4 different
    types of nucleotides adenine (A), thiamine (T),
    cytosine (C) and guanine (G). These nucleotides
    are sometimes also called bases

17
Human DNA (Cont.)
  • All people are different, but the DNA of
    different people only varies for 0.2 or less.
    So, only 2 letters in 1000 are expected to be
    different. Over the whole genome, this means that
    about 3 million letters would differ between
    individuals.
  • The structure of DNA is the so-called double
    helix, discovered by Watson and Crick in 1953,
    where the two helices are cross-linked by A-T and
    C-G base-pairs (nucleotide pairs so-called
    Watson-Crick base pairing).

18
Modern bioinformatics is closely associated with
genomics
  • The aim is to solve the genomics information
    problem
  • Ultimately, this should lead to biological
    understanding how all the parts fit (DNA, RNA,
    proteins, metabolites) and how they interact
    (gene regulation, gene expression, protein
    interaction, metabolic pathways, protein
    signalling, etc.)
  • More in the next lecture
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