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J

Julien Michel

the university of edinburgh

42H-index
158Paper Count
5.9KCitation Count
Published Papers 60
Publication Date
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Computational Design; Synthesis; and Evaluation of Stapled Peptide-Based Antagonists of the CGRP Receptor
errJournal of Medicinal Chemistry
IF6.8
err2026-03-06
err0
PREAI
errAdam L. Schofield; Evangelia Notari; Mária Rožňovcová; Kathryn W. Cox; Vera D’Aloisio; Christian Steuer; Julien Michel; Graeme S. Cottrell; Christopher R. Coxon
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Molecular driving force of a small molecule-induced protein disorder-order transition
errCommunications Chemistry
IF6.2
err2026-01-14
err0
errOAAI
errCesar Mendoza-Martinez; Arun A. Gupta; Salomé Llabrés; Paul N. Barlow; Julien Michel
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errSave
Accurate Prediction of Drug Resistance for Intrinsically Disordered Protein Regions
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-12-01
err0
PREAI
errKalpokas, Audrius; Mackey, Mark; Michel, Julien
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Enhancing Electrostatic Embedding for ML/MM Free Energy Calculations
errJournal of Chemical Theory and Computation
IF5.5
err2025-11-10
err0
PREAI
errJoão Morado; Kirill Zinovjev; Lester O. Hedges; Daniel J. Cole; Julien Michel
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errSave
Modular and Interoperable Workflows for Benchmarking Alchemical Binding Free Energy Calculation Methodologies
errJournal of Chemical Information and Modeling
IF5.3
err2025-09-25
err0
PREAI
errAnna M. Herz; Maicol Bissaro; Carmen Esposito; Julien Michel
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Elucidation of the mechanism of partial activation of EPAC1 allosteric modulators by Markov state modelling
errChem. Sci.
IF7.4
err2025-08-13
err0
errOAAI
errAdele Hardie ‡; Frederick G. Powell; Silvia Lovera §; Stephen J. Yarwood; Graeme Barker; Julien Michel
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Assessment of the Topology and Oligomerisation States of Coiled Coils Using Metadynamics with Conformational Restraints
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-03-01
err0
errOAAI
errNotari, Evangelia; Wood, Christopher W.; Michel, Julien
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errSave
Robust Automated Truncation Point Selection for Molecular Simulations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-12-23
err0
errOAAI
errClark, Finlay; Cole, Daniel J.; Michel, Julien
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Comparison of Methodologies for Absolute Binding Free Energy Calculations of Ligands to Intrinsically Disordered Proteins
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-10-28
err0
errOAAI
errPapadourakis, Michail; Cournia, Zoe; Mey, Antonia S. J. S.; Michel, Julien
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Automated Adaptive Absolute Binding Free Energy Calculations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-09-10
err6
errOAAI
errClark, Finlay; Robb, Graeme R.; Cole, Daniel J.; Michel, Julien
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Sire: An interoperability engine for prototyping algorithms and exchanging information between molecular simulation programs
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-05-30
err6
errOAAI
errWoods, Christopher J.; Hedges, Lester O.; Mulholland, Adrian J.; Malaisree, Maturos; Tosco, Paolo; Loeffler, Hannes H.; Suruzhon, Miroslav; Burman, Matthew; Bariami, Sofia; Bosisio, Stefano; Calabro, Gaetano; Clark, Finlay; Mey, Antonia S. J. S.; Michel, Julien
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Compensation Method for Parallel and Iterative Real-Time Simulation of Electromagnetic Transients
errIEEE TRANSACTIONS ON POWER DELIVERY
IF3.7
err2023-08-01
err10
PREAI
errBruned, Boris; Mahseredjian, Jean; Dennetiere, Sebastien; Michel, Julien; Schudel, Marco; Bracikowski, Nicloas
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Deconstructing allostery by computational assessment of the binding determinants of allosteric PTP1B modulators
errCOMMUNICATIONS CHEMISTRY
IF6.2
err2023-06-15
err0
errOAAI
errHardie, Adele; Cossins, Benjamin P.; Lovera, Silvia; Michel, Julien
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Comparison of Receptor-Ligand Restraint Schemes for Alchemical Absolute Binding Free Energy Calculations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-06-07
err16
errOAAI
errClark, Finlay; Robb, Graeme; Cole, Daniel J.; Michel, Julien
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errSave
A fluorogenic probe for granzyme B enables in-biopsy evaluation and screening of response to anticancer immunotherapies
errNATURE COMMUNICATIONS
IF15.7
err2022-05-02
err33
errOAAI
errScott, Jamie I.; Mendive-Tapia, Lorena; Gordon, Doireann; Barth, Nicole D.; Thompson, Emily J.; Cheng, Zhiming; Taggart, David; Kitamura, Takanori; Bravo-Blas, Alberto; Roberts, Edward W.; Juarez-Jimenez, Jordi; Michel, Julien; Piet, Berber; de Vries, I. Jolanda; Verdoes, Martijn; Dawson, John; Carragher, Neil O.; Connor, Richard A. O'; Akram, Ahsan R.; Frame, Margaret; Serrels, Alan; Vendrell, Marc
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Identification of Molecular Fragments in Equilibrium with Polysiloxane Ultrasmall Nanoparticles
errNANOMATERIALS
IF4.3
err2022-02-22
err0
errOAAI
errRocchi, Paul; Labied, Lucie; Doussineau, Tristan; Julien, Michel; Giroud, Barbara; Vulliet, Emmanuelle; Randon, Jerome; Tillement, Olivier; Hagege, Agnes; Lux, Francois
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errSave
Data-driven generation of perturbation networks for relative binding free energy calculations
errDIGITAL DISCOVERY
IF5.6
err2022-01-01
err4
errOAAI
errScheen, Jenke; Mackey, Mark; Michel, Julien
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Energetics of a protein disorder-order transition in small molecule recognition
errCHEMICAL SCIENCE
IF7.4
err2022-01-01
err13
errOAAI
errMendoza-Martinez, Cesar; Papadourakis, Michail; Llabres, Salome; Gupta, Arun A.; Barlow, Paul N.; Michel, Julien
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Implementation of the QUBE Force Field in SOMD for High-Throughput Alchemical Free-Energy Calculations
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2021-04-22
err6
errOAAI
errNelson, Lauren; Bariami, Sofia; Ringrose, Chris; Horton, Joshua T.; Kurdekar, Vadiraj; Mey, Antonia S. J. S.; Michel, Julien; Cole, Daniel J.
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errSave
Combining Virtual Reality Visualization with Ensemble Molecular Dynamics to Study Complex Protein Conformational Changes
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2020-11-12
err8
errOAAI
errJuarez-Jimenez, Jordi; Tew, Philip; O'Connor, Michael; Llabres, Salome; Sage, Rebecca; Glowacki, David; Michel, Julien
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Research Directions

No research directions
Co-authors
Cooperation Journals
B
Benoı̂t Roux
H-index: 128 · Papers: 722
W
William L. Jorgensen
H-index: 120 · Papers: 781
A
Alexandra M. Z. Slawin
H-index: 106 · Papers: 5.3K
M
Mark S.P. Sansom
H-index: 105 · Papers: 962
C
Craig M. Crews
H-index: 98 · Papers: 315
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