Lv3
390 积分 2025-10-28 加入
Theoretical study of the substituent effects on the ESIPT mechanism of salicylideneaniline and the TICT photochemistry reactions
7天前
已完结
Unlocking Photocyclization via Hydrogen-Bond Disruption: A Theoretical Investigation of Esterification-Gated Diarylethene Switches
7天前
已完结
Long-range proton transfer mechanism and fluorescence properties of HQBT chromophore: TD-DFT/CASSCF study
7天前
已完结
High-Throughput Screening of Antioxidant Drug Candidates from Natural Antioxidants with a “Zero” Intrinsic Fluorescence Peroxynitrite Sensing Precursor
9天前
已完结
An open-source drug discovery platform enables ultra-large virtual screens
9天前
已完结
Generative AI for navigating synthesizable chemical space
9天前
已完结
Harnessing generative AI for efficient organic materials discovery in low-data regimes
12天前
已完结
Glycosylation-driven bioactivity switching: Comparative pharmacology and translational prospects of oroxin and baicalein
16天前
已完结
Investigations on the Multiple Excited State Intramolecular Proton Transfer Processes and Twisted Intramolecular Charge Transfer/Twisted Intramolecular Charge Shuttle States of a Fluorescence Sensor Based on Schiff Base
18天前
已完结
Design and performance analysis of multi-enzyme activity-doped nanozymes assisted by machine learning
25天前
已完结
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