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Publications by Fabrizio Marinelli
Ensemble-Biased Metadynamics: A Molecular Simulation Method to Sample Experimental Distributions
Biophysical Journal
Biophysics
Confidence Analysis of DEER Data and Its Structural Interpretation With Ensemble-Biased Metadynamics
Biophysical Journal
Biophysics
Related publications
Quantum Chemical Molecular Dynamics and Metadynamics Simulation of Aluminium Binding to Amyloid-Β and Related Peptides
Royal Society Open Science
Multidisciplinary
A System Simulation Approach to Ensemble Prediction
Monthly Weather Review
Atmospheric Science
Comparing Simulated and Experimental Molecular Cluster Distributions
Faraday Discussions
Theoretical Chemistry
Physical
Proton Exchange in a Paramagnetic Chemical Exchange Saturation Transfer Agent From Experimental Studies and Ab Initio Metadynamics Simulation
Inorganic Chemistry
Inorganic Chemistry
Chemistry
Theoretical Chemistry
Physical
A Method for Ensemble Expansion and Improved Definition of Forecast Distributions From Climate Simulations
Quarterly Journal of the Royal Meteorological Society
Atmospheric Science
What Is the Active Site for the Oxidative Coupling of Methane Catalyzed by MgO? A Metadynamics-Biased Ab Initio Molecular Dynamics Study
An Introduction to Classical Molecular Dynamics Simulation for Experimental Scattering Users
Journal of Applied Crystallography
Biochemistry
Genetics
Molecular Biology
Application of Paramagnetic NMR-Validated Molecular Dynamics Simulation to the Analysis of a Conformational Ensemble of a Branched Oligosaccharide
Molecules
Organic Chemistry
Molecular Medicine
Analytical Chemistry
Theoretical Chemistry
Pharmaceutical Science
Medicine
Drug Discovery
Chemistry
Physical
