Publications by authors named "Emma Danelius"

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Conformational Trajectory of the Molecular Chameleon Grazoprevir from Formulation to Target-Bound.
Lianne H E Wieske, Guanhong Bu, Máté Erdélyi, Jan Kihlberg, Tamir Gonen, Emma Rova Danelius

Chemistry· December 2025

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Eliminating the missing cone challenge through innovative approaches.
Cody Gillman, Guanhong Bu, Emma Danelius, Johan Hattne, Brent L Nannenga

J Struct Biol X· June 2024

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Polymorphic Structure Determination of the Macrocyclic Drug Paritaprevir by MicroED.
Guanhong Bu, Emma Danelius, Lianne H E Wieske, Tamir Gonen

Adv Biol (Weinh)· May 2024

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Eliminating the Missing Cone Challenge through Innovative Approaches.
Cody Gillman, Guanhong Bu, Emma Danelius, Johan Hattne, Brent Nannenga

bioRxiv· January 2024

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MicroED as a Powerful Tool for Structure Determination of Macrocyclic Drug Compounds Directly from Their Powder Formulations.
Emma Danelius, Guanhong Bu, Lianne H E Wieske, Tamir Gonen

ACS Chem Biol· December 2023

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MicroED in drug discovery.
Emma Danelius, Khushboo Patel, Brenda Gonzalez, Tamir Gonen

Curr Opin Struct Biol· April 2023

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MicroED Structure of a Protoglobin Reactive Carbene Intermediate.
Emma Danelius, Nicholas J Porter, Johan Unge, Frances H Arnold, Tamir Gonen

J Am Chem Soc· April 2023

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Correction to "Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction".
Fabio Begnini, Stefan Geschwindner, Patrik Johansson, Lisa Wissler, Richard J Lewis, Emma Danelius

J Med Chem· February 2023

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Biocatalytic Carbene Transfer Using Diazirines.
Nicholas J Porter, Emma Danelius, Tamir Gonen, Frances H Arnold

J Am Chem Soc· May 2022

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Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction.
Fabio Begnini, Stefan Geschwindner, Patrik Johansson, Lisa Wissler, Richard J Lewis, Emma Danelius

J Med Chem· February 2022

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Protein and Small Molecule Structure Determination by the Cryo-EM Method MicroED.
Emma Danelius, Tamir Gonen

Methods Mol Biol· August 2021

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MicroED in natural product and small molecule research.
Emma Danelius, Steve Halaby, Wilfred A van der Donk, Tamir Gonen

Nat Prod Rep· March 2021

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Solution Conformations Explain the Chameleonic Behaviour of Macrocyclic Drugs.
Emma Danelius, Vasanthanathan Poongavanam, Stefan Peintner, Lianne H E Wieske, Máté Erdélyi

Chemistry· April 2020

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Dynamic Chirality in the Mechanism of Action of Allosteric CD36 Modulators of Macrophage-Driven Inflammation.
Emma Danelius, Ragnhild G Ohm, Ahsanullah, Mukandila Mulumba, Huy Ong

J Med Chem· December 2019

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A Chemical Biology Approach to Understanding Molecular Recognition of Lipid II by Nisin(1-12): Synthesis and NMR Ensemble Analysis of Nisin(1-12) and Analogues.
Rachael Dickman, Emma Danelius, Serena A Mitchell, D Flemming Hansen, Máté Erdélyi

Chemistry· November 2019

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Conformational Sampling of Macrocyclic Drugs in Different Environments: Can We Find the Relevant Conformations?
Vasanthanathan Poongavanam, Emma Danelius, Stefan Peintner, Lilian Alcaraz, Giulia Caron

ACS Omega· September 2018

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Halogen Bonding: A Powerful Tool for Modulation of Peptide Conformation.
Emma Danelius, Hanna Andersson, Patrik Jarvoll, Kajsa Lood, Jürgen Gräfenstein

Biochemistry· June 2017

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Assessing the Ability of Spectroscopic Methods to Determine the Difference in the Folding Propensities of Highly Similar β-Hairpins.
Hanna Andersson, Emma Danelius, Patrik Jarvoll, Stephan Niebling, Ashley J Hughes

ACS Omega· February 2017

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Flexibility is important for inhibition of the MDM2/p53 protein-protein interaction by cyclic β-hairpins.
Emma Danelius, Mariell Pettersson, Matilda Bred, Jaeki Min, M Brett Waddell

Org Biomol Chem· November 2016

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The impact of interchain hydrogen bonding on β-hairpin stability is readily predicted by molecular dynamics simulation.
Stephan Niebling, Emma Danelius, Ulrika Brath, Sebastian Westenhoff, Máté Erdélyi

Biopolymers· November 2015

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