All papers authored by Isabella Daidone
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2024
Sinjini Bhattacharjee 
,
Srilatha Arra ,
Isabella Daidone ,
Dimitrios A. Pantazis
,
Srilatha Arra ,
Isabella Daidone ,
Dimitrios A. Pantazis
Excitation landscape of the CP43 photosynthetic antenna complex from multiscale simulations
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2021
Anna Pavlova ,
Diane L. Lynch,
Isabella Daidone ,
Laura Zanetti-Polzi ,
Micholas Dean Smith,
Chris Chipot,
Daniel W. Kneller ,
Andrey Kovalevsky ,
Leighton Coates ,
Andrei A. Golosov,
Callum J. Dickson,
Jeremy C. Smith,
Camilo Velez-Vega,
Jose S. Duca ,
Josh V. Vermaas
and 5 other authors
,
Diane L. Lynch,
Isabella Daidone ,
Laura Zanetti-Polzi ,
Micholas Dean Smith,
Chris Chipot,
Daniel W. Kneller ,
Andrey Kovalevsky ,
Leighton Coates ,
Andrei A. Golosov,
Callum J. Dickson,
Jeremy C. Smith,
Camilo Velez-Vega,
Jose S. Duca ,
Josh V. Vermaas
and 5 other authors
Inhibitor binding influences the protonation states of histidines in SARS-CoV-2 main protease
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2020
Atanu Acharya ,
Rupesh Agarwal ,
Matthew B. Baker,
Jerome Baudry ,
Debsindhu Bhowmik ,
Swen Boehm,
Kendall G. Byler,
Sam Yen-Chi Chen,
Leighton Coates ,
Connor J. Cooper ,
Omar Demerdash,
Isabella Daidone ,
John D. Eblen,
Sally R. Ellingson,
Stefano Forli
and 37 other authors
,
Rupesh Agarwal ,
Matthew B. Baker,
Jerome Baudry ,
Debsindhu Bhowmik ,
Swen Boehm,
Kendall G. Byler,
Sam Yen-Chi Chen,
Leighton Coates ,
Connor J. Cooper ,
Omar Demerdash,
Isabella Daidone ,
John D. Eblen,
Sally R. Ellingson,
Stefano Forli
and 37 other authors
Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19
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2019
Valeria Giliberti,
Raffaella Polito ,
Eglof Ritter,
Matthias Broser,
Peter Hegemann ,
Ljiljana Puskar,
Ulrich Schade,
Laura Zanetti-Polzi ,
Isabella Daidone ,
Stefano Corni ,
Francesco Rusconi,
Paolo Biagioni ,
Leonetta Baldassarre ,
Michele Ortolani
Download from pubs.acs.org
,
Eglof Ritter,
Matthias Broser,
Peter Hegemann ,
Ljiljana Puskar,
Ulrich Schade,
Laura Zanetti-Polzi ,
Isabella Daidone ,
Stefano Corni ,
Francesco Rusconi,
Paolo Biagioni ,
Leonetta Baldassarre ,
Michele Ortolani
Download from pubs.acs.org
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