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PhD in Molecular Modelling | NTHRYS | PhD Research Outsourcing

This program covers quantum mechanics, docking, homology modelling, coarse graining, implicit and explicit solvent models, scoring functions, virtual screening and multi objective optimisation

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Molecular Modelling PhD Research Assistance by NTHRYS

PhD in Molecular Modelling develops and applies computational models to predict structure, energetics and reactivity of molecules and complexes in chemistry and biology. This program covers quantum mechanics, docking, homology modelling, coarse graining, implicit and explicit solvent models, scoring functions, virtual screening and multi objective optimisation. Researchers create integrated modelling workflows, validate predictions with experimental data, publish in computational chemistry and structural biology journals and support rational design of ligands, catalysts and materials.
PhD Focused Areas
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