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Deep Learning for Multiscale Molecular Modelling
Jan 16 2019
Multiscale Modeling on Metalloenzymes: Insights Beyond Experiments
Jan 16 2019
Towards Efficient Orbital-Dependent Density Functionals for Weak and Strong Correlation
Dec 19 2018
Two Interesting Kinetic Isotope Effects in Organic Reactions and Multi-Scale ONIOM Methods
Dec 5 2018
Biomineralization of Hydroxyapatite Assisted by I-type Collagen
Nov 21 2018
Principles Governing Catalytic Activity of Self-Assembled Short Peptides
Nov 7 2018
Electronic Polarization in Macromolecular Structure and Dynamics
Oct 30 2018
Multi-Scale Modeling of Cell Membranes: The Importance of Electrostatic Interactions
Oct 24 2018
Reactive Molecular Dynamics Study of Chemical Reactions at Extreme Conditions
Oct 10 2018
Integrative Structural Modeling of Intrinsically Disordered Proteins
Sep 26 2018
Computational Investigations on Target-Site Searching and Recognition Mechanism
Sep 19 2018
Purely Organic Room-Temperature Phosphorescent Materials: Design and Applications
Sep 12 2018
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