Gianmarc Grazioli

发表

Enhanced Sampling Methods for the Computation of Conformational Kinetics in Macromolecules

Gianmarc Grazioli, 2016 .

Algorithms for Parameterizing Network Hamiltonians for Simulations of Amyloid Fibril Self-assembly

Yue Yu, Carter T. Butts, Gianmarc Grazioli, 2020 .

Advances in milestoning. II. Calculating time-correlation functions from milestoning using stochastic path integrals.

Gianmarc Grazioli, Ioan Andricioaei, I. Andricioaei, 2018, The Journal of chemical physics.

Predicting Reaction Products and Automating Reactive Trajectory Characterization in Molecular Simulations with Support Vector Machines

Gianmarc Grazioli, Carter T Butts, Saswata Roy, 2019, J. Chem. Inf. Model..

Advances in milestoning. I. Enhanced sampling via wind-assisted reweighted milestoning (WARM).

Gianmarc Grazioli, Ioan Andricioaei, I. Andricioaei, 2018, The Journal of chemical physics.

Comparative Exploratory Analysis of Intrinsically Disordered Protein Dynamics Using Machine Learning and Network Analytic Methods

Carter T. Butts, Gianmarc Grazioli, Rachel W. Martin, 2019, Front. Mol. Biosci..

Local Graph Stability in Exponential Family Random Graph Models pdf

Carter T. Butts, Gianmarc Grazioli, Yue Yu, 2019, SIAM J. Appl. Math..

Neural Upscaling from Residue-Level Protein Structure Networks to Atomistic Structures

Carter T. Butts, Gianmarc Grazioli, Rachel W. Martin, 2021, Biomolecules.

m1A and m1G Potently Disrupt A-RNA Structure Due to the Intrinsic Instability of Hoogsteen Base Pairs

Gianmarc Grazioli, Ioan Andricioaei, Hashim M. Al-Hashimi, 2016, Nature Structural &Molecular Biology.

Network-Based Classification and Modeling of Amyloid Fibrils.

Gianmarc Grazioli, Carter T Butts, Megha H. Unhelkar, 2019, The journal of physical chemistry. B.