AIIC AI Intelligence Centre

SOURCE-LINKED INTELLIGENCE

Mechanism Identification and High-Throughput Screening of Molecules for the Hydrogen Evolution Reaction

CORDIS · observation · Publication date unknown

ture the structure-activity relationships of organic molecules. High-throughput screening based on these descriptors is employed to identify promising HER catalysts from millions of molecules through machine learning approaches. These active candidates are further validated through theoretical calculations and experimental measurements. By combining mechanism analysis, descriptor construction, high-throughput screening, and validation, the workflow not only identifies new molecular catalysts for HER, but also provides a valuable framework for screening and discovering other materials. High-throughput screening

Read original source ↗ Open in workspace

recordType
award
status
SIGNED
region
EU
value
260347.92
unit
EUR

Evidence & attribution

European Commission, CORDIS Horizon Europe project dataset. Metadata adapted.

License: CORDIS reuse policy

First collected: 2026-09-20T04:21:15.460Z. This is not the publication date.