Description
This workshop aims to catalyse collaborations between biological scientists and computational chemists. The workshop will be of particular interest to biological scientists who require new chemical reagents to help them to better understand biological mechanism and to computational biologists/chemists who wish to apply computational ligand discovery methods to a biological problem.| Period | 15 Nov 2013 |
|---|---|
| Event type | Conference |
| Location | London, United KingdomShow on map |
Keywords
- biochemistry
- computational chemistry
- computational biophysics
- biophysics
- molecular simulation
- drug discovery
- pharmacy
- industry
Documents & Links
Related content
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Research output
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In silico screening of bioactive and biomimetic solutes using Integral Equation Theory
Research output: Contribution to journal › Article › peer-review
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Initial stage of cheese production: a molecular modeling study of bovine and camel chymosin complexed with peptides from the chymosin-sensitive region of kappa-casein
Research output: Contribution to journal › Article › peer-review
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Solvent binding analysis and computational alanine scanning of the bovine chymosin-bovine κ-casein complex using molecular integral equation theory
Research output: Contribution to journal › Article › peer-review
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Hot-spot mapping of the interactions between chymosin and bovine κ-casein
Research output: Contribution to journal › Article › peer-review
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Protein modelling using molecular integral equation theory: applications to chymosin—κ-casein complexes
Research output: Contribution to conference › Poster
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Bovine chymosin: a computational study of recognition and binding of bovine kappa-casein
Research output: Contribution to journal › Article › peer-review
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Projects
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Novel Methods to Calculate Hydration Thermodynamic Parameters for Pharmaceutical and Pollutant Molecules
Project: Internally funded project
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CALCULATION OF PHARMACOKINETIC PROPERTIES OF DRUGLIKE MOLECULES USING INTEGRAL EQUATION THEORY
Project: Research Fellowship