What Are Some Practical Applications of Neo4j in Catalysis?
Neo4j can be used in various practical applications within catalysis, including:
Reaction Mechanism Elucidation: By mapping out all possible reaction pathways and intermediates, researchers can use Neo4j to identify the most likely mechanisms. Catalyst Design and Optimization: Neo4j can help in understanding the structure-activity relationships and guiding the design of more efficient catalysts. Data Integration: Combining data from different sources (experimental, computational, literature) into a single graph database to gain comprehensive insights. Predictive Modeling: Using the interconnected data to develop predictive models for catalytic performance and reaction outcomes.
