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non-bilayer_simulations
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| - | Example Setups: | + | ==== Protein and FEP Simulations ==== |
| - | [[ REST2 ]] | ||
| - | [[Water Soluble Protein ]] Equilibration and Production Run | + | [[ REST2 ]] for enhanced sampling using solute tempering. |
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| + | [[Water Soluble Protein ]] Equilibration and Production Run. | ||
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| + | Free Energy Perturbation ([[FEP]]) | ||
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| + | ==== Protein Analysis ==== | ||
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| + | Phi/psi [[ Map ]] | ||
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| + | [[Secondary structure vs time]] | ||
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| + | ==== Gas Hydrate Simulations ==== | ||
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| + | [[Simulating Hydrocarbon Mixtures]] | ||
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| + | [[Building a Hydrate Lattice]] | ||
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| + | ==== Running Simulations using GROMACs ==== | ||
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| + | [[Gromacs]] | ||
non-bilayer_simulations.1510155475.txt.gz · Last modified: 2017/11/08 10:37 by admin