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Molecular Dynamics Workshops

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Showing 1–12 of 50 categories
MD Simulation Fundamentals for Beginners
Introduction to molecular dynamics principles, force fields, and basic simulation setup for professionals new to computational chemistry.
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GROMACS Software Essentials Workshop
Hands-on training in GROMACS molecular dynamics package installation, configuration, and execution for computational researchers.
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AMBER MD Platform Practical Training
Comprehensive workshop on AMBER force field application and molecular dynamics simulations for biochemical systems.
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NAMD Advanced Simulation Techniques
Expert-level training in NAMD parallel computing for large-scale molecular dynamics simulations on HPC clusters.
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Protein Folding Simulation Methods
Specialized training in computational techniques for modeling protein structure prediction and folding dynamics.
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Molecular Docking and MD Integration
Practical course on coupling molecular docking with molecular dynamics for drug discovery and screening.
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Force Field Development and Parameterization
Advanced workshop on creating custom force fields and parameter optimization for specialized molecular systems.
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Free Energy Calculations in MD
Technical training in thermodynamic sampling methods and binding affinity predictions using molecular dynamics.
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Molecular Dynamics Data Analysis
Hands-on course in trajectory analysis, statistical processing, and visualization of MD simulation results.
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High Performance Computing for MD
Training program on GPU acceleration, parallel computing, and HPC resource optimization for molecular dynamics.
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Temperature and Pressure Control Systems
Practical workshop on thermostat and barostat implementation, ensemble selection, and NPT simulations.
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Periodic Boundary Conditions Theory
Fundamental training on PBC implementation, system size effects, and long-range interaction calculations in MD.
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