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Research Abroad Products

Molecular Modelling Workshops

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Showing 13–24 of 50 categories
High-Performance Computing HPC Implementation
Advanced technical training in parallel computing, cluster job submission, and GPU acceleration for large-scale simulations.
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Machine Learning for Molecular Property Prediction
Cutting-edge training integrating machine learning models with molecular modelling for property prediction specialists.
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Drug Discovery Workflow Integration
Professional certification program linking molecular modelling to experimental drug discovery processes for medicinal chemists.
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OPLS and MMFF Force Field Parameterization
Intermediate training in force field selection, parameter validation, and small-molecule optimization for chemistry professionals.
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Conformational Analysis and Ring Puckering
Specialist workshop teaching conformer generation, energy surface mapping, and stability assessment for organic chemists.
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Molecular Properties and Descriptor Calculation
Technical training covering QSAR descriptor generation, LogP prediction, and molecular property calculations for modellers.
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NAMD Simulation Software Training
Comprehensive program covering NAMD installation, configuration, and troubleshooting for large biomolecular systems.
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Desmond and Schrödinger Suite Workflow
Professional training in Schrödinger tools integration, Desmond MD setup, and computational chemistry pipeline development.
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TINKER Molecular Modeling Engine
Specialized workshop covering TINKER force field, analysis tools, and molecular optimization for advanced practitioners.
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Molecular Dynamics Trajectory Analysis
Intermediate training in statistical analysis, hydrogen bonding patterns, and cluster analysis of simulation data.
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Enhanced Sampling and Umbrella Sampling
Advanced specialist course covering metadynamics, replica exchange, and rare event simulation techniques.
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Automated Workflow and Scripting Automation
Technical training in Python scripting, workflow automation, and data pipeline development for efficiency optimization.
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