Utilizing chemical domain knowledge and machine learning for nanoparticle and biochemical spectroscopic analysis

• Main Author: Tan, Emily Xi
• Other Authors: Ling Xing Yi
• Format: Thesis-Doctor of Philosophy
• Language: English
• Published: Nanyang Technological University 2025
• Subjects: Chemistry; Machine learning; Surface enhanced raman scattering; Plasmonics; Nanomaterial synthesis
• Online Access: https://hdl.handle.net/10356/182230
• Institution: Nanyang Technological University

Rapid and accurate chemical analysis is desirable in many scientific and technological fields but remains challenging. This thesis demonstrates the integration of domain knowledge-driven feature engineering and machine learning (ML) with UV-vis and SERS spectroscopic analyses for high-throughput...