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What is Computational Biology ?

What is Computational Biology ?

What is Computational Biology ?. Structural Biology & Biophysics Computational Chemistry of Biological Molecules Genomics and Proteomics Systems Biology. Molecular Simulations in Structural Biology. Molecular Structure and Function (e.g. enzymes) Protein Folding and Binding

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890 views • 47 slides
Bogdan Lesyng Interdyscyplinary Centre for Mathematical and Computational Modelling

Bogdan Lesyng Interdyscyplinary Centre for Mathematical and Computational Modelling

Coupling of SCC-DFTB, Generalized Born and Hydrophobic Models in Description of Hydration Free Energies. Bogdan Lesyng Interdyscyplinary Centre for Mathematical and Computational Modelling and Faculty of Physics, University of Warsaw (http://www.icm.edu.pl/~lesyng) and

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502 views • 41 slides
Important coordinates

Important coordinates

Effective Potentials for Protein Folding and Binding With Thermodynamic Constraints. Effective potential. Important coordinates. The AGBNP effective solvation potential Optimization for structure prediction Free energy surfaces for b -hairpin and a -helical peptide folding

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408 views • 28 slides
Generalized Born Approach to Continuum Electrostatics

Generalized Born Approach to Continuum Electrostatics

Generalized Born Approach to Continuum Electrostatics. Sampath Koppole. Brief outline of the Talk:. Introduction to Continuum Electrostatics: Continuum Electrostatics --- What is it ?? Solvation free energy ?G sol --- its Components. What are we interested in ??.

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415 views • 17 slides
Generalized Born Approach to Continuum Electrostatics

Generalized Born Approach to Continuum Electrostatics

Generalized Born Approach to Continuum Electrostatics. Sampath Koppole. Brief outline of the Talk:. Introduction to Continuum Electrostatics: Continuum Electrostatics --- What is it ?? Solvation free energy ?G sol --- its Components. What are we interested in ??.

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312 views • 17 slides

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