Jonathan Barnoud
University of Bristol
H-index: 22
Europe-United Kingdom
Top articles of Jonathan Barnoud
Martini 3 Coarse-Grained Force Field for Cholesterol
Journal of Chemical Theory and Computation
2023/10/5
Free energy along drug-protein binding pathways interactively sampled in virtual reality
Scientific Reports
2023/10/4
Kirill Zinovjev
H-Index: 10
Jonathan Barnoud
H-Index: 13
Building a community-driven ecosystem for fast, reproducible, and reusable molecular simulation analysis using mdanalysis
Biophysical journal
2023/2/10
Martinize2 and vermouth: Unified framework for topology generation
arXiv preprint arXiv:2212.01191
2022/11/29
Jonathan Barnoud
H-Index: 13
The emerging potential of interactive virtual reality in drug discovery
2022/7/3
Jonathan Barnoud
H-Index: 13
Interactive virtual reality holds great potential in drug discovery
2022/5/16
Jonathan Barnoud
H-Index: 13
Virtual reality sampled pathways guide free energy calculation of protein-ligand binding
2022/4/19
Kirill Zinovjev
H-Index: 10
Jonathan Barnoud
H-Index: 13
Adrian Mulholland
H-Index: 35
Marc Van Der Kamp
H-Index: 21
MDAnalysis 2.0 and beyond: fast and interoperable, community driven simulation analysis
Biophysical Journal
2022/2/11
Interactivity: the missing link between virtual reality technology and drug discovery pipelines
2022/2/8
Jonathan Barnoud
H-Index: 13
Martini 3 coarse‐grained force field: small molecules
Advanced Theory and Simulations
2022/1
Riccardo Alessandri
H-Index: 8
Jonathan Barnoud
H-Index: 13
Martini 3: a general purpose force field for coarse-grained molecular dynamics
Nature methods
2021/4
Interactive molecular dynamics in virtual reality is an effective tool for flexible substrate and inhibitor docking to the SARS-CoV-2 main protease
The Journal of chemical physics
2019/6/14
Resolving donor–acceptor interfaces and charge carrier energy levels of organic semiconductors with polar side chains
Advanced Functional Materials
2020/11
Piezo1 forms specific, functionally important interactions with phosphoinositides and cholesterol
Biophysical journal
2020/10/20
Narupa iMD: a VR-enabled multiplayer framework for streaming interactive molecular simulations
2020/8/17
Jonathan Barnoud
H-Index: 13
Titratable Martini model for constant pH simulations
The Journal of chemical physics
2020/7/14
Haleh Abdizadeh
H-Index: 9
Jonathan Barnoud
H-Index: 13
Coupling coarse-grained to fine-grained models via Hamiltonian Replica Exchange
Journal of Chemical Theory and Computation
2020/6/22
Yang Liu
H-Index: 18
Jonathan Barnoud
H-Index: 13
Dual resolution membrane simulations using virtual sites
The Journal of Physical Chemistry B
2020/4/21
Sex and Ontogenetic Variation in the Crest of Numida meleagris: Implications for Crested Vertebrates
The Anatomical Record
2020/4
Delphine Angst
H-Index: 10
Jonathan Barnoud
H-Index: 13
Capturing choline–aromatics cation− π interactions in the MARTINI force field
Journal of chemical theory and computation
2020/2/25
Co-Authors
