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Field
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and applications. Excellent written communication skills, as evidenced in application materials. Preferred Qualifications Experience with molecular dynamics simulations and analyses, cheminformatics
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spectroscopy and molecular dynamics simulations: We develop and apply novel ultrafast spectroscopic methods aimed at uncovering how changes in light, environment and structure switch the function of photoactive
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with molecular simulation tools (GROMACS, CHARMM, etc) and/or multiscale and coarse-grained approaches, such as Normal Mode Analysis, Brownian Dynamics, etc. are a prerequisite. Extensive expertise in
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developing a protocol gathering an array of state of-the-art computational techniques: ab initio methods, molecular dynamics, enhanced sampling techniques (metadynamics, umbrella sampling) and machine learning
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Profound scientific knowledge and experience in: protein crystal structure analysis virtual screening, ensemble docking, molecular dynamics simulations ligand-protein interactions, protein-protein
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, Chemistry, Physics, Pharmacy, or a related discipline with expertise in computation, molecular dynamics simulation, and statistical mechanics. For a further description of current research projects see https
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, bioengineering, or a closely related field, with a strong interest in biological systems are particularly encouraged to apply. We seek candidates with expertise in some of the following areas: molecular dynamics
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conduct fundamental research in chemical separations using computational methods, including free energy methods with molecular dynamics simulations. The position will focus on solution phase separations
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molecular dynamics simulations (including application of molecular mechanics and/or semiempirical methods). Practical skills in use of molecular modeling software such as Gaussian, GROMACS, VMD, Discovery
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EPR experiments for ultra-sensitive spectroscopy, quantum magnetometry and quantum state control. The project educates the student in multiscale modelling featuring molecular dynamics simulations