ASCEND BY NTHRYS
Research Abroad Products

Chemiinformatics Workshops

Click a category to proceed further.

Showing 13–24 of 50 categories
Chemical Structure Validation Techniques
Hands-on training in validating molecular structures, detecting errors, and ensuring data quality for database administrators.
3+WORKSHOPS
PROGRAMMES
Structure Canonicalization and SMILES Normalization Workflows 2D Structure Connectivity Validation Using Graph Algorithms Molecular Fingerprint Validation for Similarity Assessment +2 more programmes
Explore workshops →
Virtual Screening Workflow Design
Advanced course on designing and executing virtual screening campaigns for drug discovery scientists.
3+WORKSHOPS
PROGRAMMES
Ligand Based Pharmacophore Modeling Techniques Structure Based Molecular Docking Protocol Development ADMET Property Prediction and Filtering Workflows +2 more programmes
Explore workshops →
Metabolite Prediction and Analysis
Training on predicting drug metabolism and bioavailability using computational tools for pharmaceutical researchers.
3+WORKSHOPS
PROGRAMMES
ADMET Property Prediction Using Machine Learning Phase I and Phase II Metabolite Structure Elucidation Metabolic Pathway Modeling with Cytoscape and Systems Chemistry +2 more programmes
Explore workshops →
Chemical Reaction Database Curation
Specialized training in managing reaction databases and reaction data standardization for data curators.
3+WORKSHOPS
PROGRAMMES
Reaction Ontology Design and RDF Mapping High Throughput Reaction Data Validation Pipelines Structure Standardization in Reaction Curation +2 more programmes
Explore workshops →
Molecular Descriptor Calculation
Technical training on calculating and interpreting molecular descriptors for property prediction and modeling.
3+WORKSHOPS
PROGRAMMES
RDKit Molecular Descriptor Generation Pipeline Quantum Mechanical Descriptor Computation for Drug Design Fingerprint Generation and Molecular Similarity Assessment +2 more programmes
Explore workshops →
Patent Mining and Chemical Intelligence
Advanced course on extracting chemical information from patents using text mining and informatics tools.
3+WORKSHOPS
PROGRAMMES
Chemical Structure Database Mining Techniques Patent Landscape Analysis for Chemistry Innovation Molecular Property Prediction and QSAR Modeling +2 more programmes
Explore workshops →
Pipeline Pilot Workflow Development
Hands-on training in designing and automating chemiinformatics workflows using Pipeline Pilot for research scientists.
3+WORKSHOPS
PROGRAMMES
Advanced Pipeline Pilot Component Development and Integration Molecular Property Prediction Workflow Design and Optimization High-Throughput Virtual Screening Pipeline Configuration +2 more programmes
Explore workshops →
Toxicity Prediction Models
Specialized training on building and validating predictive toxicity models for safety assessment professionals.
3+WORKSHOPS
PROGRAMMES
QSAR Model Development and Validation Workflows Molecular Descriptor Engineering for Toxicity Classification Deep Learning Architectures for Chemical Toxicity Prediction +2 more programmes
Explore workshops →
Bioinformatics Integration with Chemistry
Cross-disciplinary training combining bioinformatics and chemiinformatics for computational biology researchers.
3+WORKSHOPS
PROGRAMMES
Molecular Docking and Virtual Screening Workflows SMILES Notation and Chemical Descriptor Engineering Protein Structure Analysis with Cheminformatics Integration +2 more programmes
Explore workshops →
Chemical Data Mining Techniques
Advanced data mining methods for extracting patterns and knowledge from large chemical datasets.
3+WORKSHOPS
PROGRAMMES
High Throughput Screening Data Analysis and Integration Molecular Descriptor Extraction and Feature Engineering Chemical Structure Mining from Unstructured Data Sources +2 more programmes
Explore workshops →
Chemical Ontologies and Knowledge Graphs
Training on semantic web technologies and knowledge representation for chemical information specialists.
3+WORKSHOPS
PROGRAMMES
Building Chemical Ontologies with OWL and Protégé RDF and SPARQL for Chemical Knowledge Graph Construction ChEMBL and PubChem Data Integration Workflows +2 more programmes
Explore workshops →
Spectroscopy Data Analysis Software
Hands-on training in processing and interpreting NMR, MS, and IR spectroscopic data using informatics tools.
3+WORKSHOPS
PROGRAMMES
NMR Spectral Processing and Peak Assignment Workflows Mass Spectrometry Data Interpretation and Fragment Analysis Multivariate Statistical Analysis for Spectroscopic Datasets +2 more programmes
Explore workshops →