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CORDIS

Toward the microscopic simulations of cell-like environments.

CORDIS provides links to public deliverables and publications of HORIZON projects.

Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Stabilizing or Destabilizing: Simulations of Chymotrypsin Inhibitor 2 under Crowding Reveal Existence of a Crossover Temperature (opens in new window)

Author(s): Stepan Timr, Fabio Sterpone
Published in: The Journal of Physical Chemistry Letters, Issue 12/6, 2021, Page(s) 1741-1746, ISSN 1948-7185
Publisher: American Chemical Society
DOI: 10.1021/acs.jpclett.0c03626

The Unfolding Journey of Superoxide Dismutase 1 Barrels under Crowding: Atomistic Simulations Shed Light on Intermediate States and Their Interactions with Crowders (opens in new window)

Author(s): Stepan Timr, David Gnutt, Simon Ebbinghaus, Fabio Sterpone
Published in: The Journal of Physical Chemistry Letters, Issue 11/10, 2020, Page(s) 4206-4212, ISSN 1948-7185
Publisher: American Chemical Society
DOI: 10.1021/acs.jpclett.0c00699

Amyloid Oligomers: A Joint Experimental/Computational Perspective on Alzheimer’s Disease, Parkinson’s Disease, Type II Diabetes, and Amyotrophic Lateral Sclerosis (opens in new window)

Author(s): Phuong H. Nguyen, Ayyalusamy Ramamoorthy, Bikash R. Sahoo, Jie Zheng, Peter Faller, John E. Straub, Laura Dominguez, Joan-Emma Shea, Nikolay V. Dokholyan, Alfonso De Simone, Buyong Ma, Ruth Nussinov, Saeed Najafi, Son Tung Ngo, Antoine Loquet, Mara Chiricotto, Pritam Ganguly, James McCarty, Mai Suan Li, Carol Hall, Yiming Wang, Yifat Miller, Simone Melchionna, Birgit Habenstein, Stepan Timr, Jiaxi
Published in: Chemical Reviews, Issue 121/4, 2021, Page(s) 2545-2647, ISSN 0009-2665
Publisher: American Chemical Society
DOI: 10.1021/acs.chemrev.0c01122

Protein thermal stability (opens in new window)

Author(s): Stepan Timr, Dominique Madern, Fabio Sterpone
Published in: Computational Approaches for Understanding Dynamical Systems: Protein Folding and Assembly, Issue 170, 2020, Page(s) 239-272, ISBN 9780128211359
Publisher: Elsevier
DOI: 10.1016/bs.pmbts.2019.12.007

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