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Fantasy vs. Reality in Fragment-Based Quantum Chemistry
Dec 10 2019
Universal Activation Mechanism of Class A GPCRs
Dec 6 2019
Variational Approach for Coarse-Graining of Molecular Kinetics
Nov 29 2019
Ab Initio Modeling of Materials for Post-lithium and Organic Batteries: Ab Initio Inspired Design Strategies and Methodology Issues
Nov 26 2019
Applications of Computational Chemistry in Understanding Catalysis
Nov 22 2019
Theoretical Chemistry under Tips: Raman and STM Images
Nov 15 2019
Strong Electron Correlation from the Perspective of Open Quantum Systems
Nov 8 2019
Nonlinear Vibrational Spectroscopy for Molecular Surfaces/Interfaces and Beyond
Nov 1 2019
Molecular Motion and Drug Discovery under a Computational Microscope
Oct 18 2019
A Shortcut to Understand Mutation Effect and Substrate Diversity in Protein Engineering: Pre-reaction State and QM/MM Calculation
Oct 11 2019
Thermal and Non-thermal Microwave Effects
Sep 27 2019
Investigating Water Dynamics at the Molecular Interfaces Using Dynamic Vibrational Spectroscopy
Sep 20 2019
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