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• Peptide docking • Virtual screening • classical explicit solvent/membrane Molecular Dynamics simulations • enhancing sampling Molecular Dynamics simulations Requirements: The ideal applicant has a strong
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Leibniz Institute for Food Systems Biology at the Technical University of MunichFood Systems Biology at the Technical University of Munich | Freising, Bayern | Germany | 13 days ago
between the human organism and food ingredients. The working group "Molecular Modeling" at Leibniz-LSB@TUM is looking for a PhD student to start on 01/07/2024. Project: Advancements in structural biology
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to identify new food-derived modulators of taste and odorant receptors. Area of responsibility includes: Ligand docking Peptide docking Virtual screening classical explicit solvent/membrane Molecular Dynamics
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docking Peptide docking Virtual screening classical explicit solvent/membrane Molecular Dynamics simulations enhancing sampling Molecular Dynamics simulations Requirements: The ideal applicant has a strong
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combination of molecular dynamics simulations and experimental techniques (solid-supported membrane electrophysiology, fluorescence spectroscopy), with the aim to understand transproter dysfunction at atomic
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, pharmacophore modeling, molecular docking, virtual screening Requirements: The ideal applicant might have various backgrounds. These backgrounds may include but are not limited to: computational chemistry
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machine learning: chemical space analyses, QSAR modeling, machine learning and relevant tools, pharmacophore modeling, molecular docking, virtual screening Requirements: The ideal applicant might have
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proteins Experience in molecular dynamics simulations, free energy calculations, machine learning/deep learning, Markov State Models, docking, or related areas Knowledge of at least one programming language