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Molecular Force Fields Enhanced by Artificial Intelligence Techniques
Sep 27 2024
Excited State Simulations of Fluorescent and Photoactive Proteins for Rational Design
Sep 20 2024
2024 International Symposium on Quantum Dynamics of Complex Systems
Jul 2 2024
2024 International Symposium on Computational Molecular Science and Machine Learning
Jun 29 2024
Machine Learning Photodynamics Uncover Blocked Non-Radiative Mechanisms in Aggregation-Induced Emission
Jun 21 2024
Theoretical Design and Working Mechanism Study of Efficient Light-Driven Molecular Motors
Jun 7 2024
Excited-State Electronic Structure Theory and Non-adiabatic Dynamics in Complex Systems
May 17 2024
Highly Efficient Global Optimization Method FGO and Its Application in Nanoclusters
May 10 2024
Quantum Decoherence and Quantum-Classical Correlation
May 10 2024
Deciphering the Acceleration Mechanisms of Organic Reactions in Microdroplets
Apr 26 2024
Elucidating the Dynamics of Proteins During Folding and Catalysis from Molecular Simulations
Jan 19 2024
Electronic Processes in Molecular Aggregates
Dec 19 2023
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