Insights into G-Quadruplex–Hemin Dynamics Using Atomistic Simulations: Implications for Reactivity and Folding

Author:

Stadlbauer Petr1ORCID,Islam Barira1ORCID,Otyepka Michal12ORCID,Chen Jielin3,Monchaud David4,Zhou Jun3ORCID,Mergny Jean-Louis135ORCID,Šponer Jiří1ORCID

Affiliation:

1. Institute of Biophysics of the Czech Academy of Sciences, Královopolská 135, 612 65 Brno, Czech Republic

2. Regional Centre of Advanced Technologies and Materials, Czech Advanced Technology and Research Institute, Palacký University, Křížkovského 8, 779 00 Olomouc, Czech Republic

3. State Key Laboratory of Analytical Chemistry for Life Science, School of Chemistry & Chemical Engineering, Nanjing University, Nanjing 210023, China

4. Institut de Chimie Moléculaire (ICMUB), CNRS UMR6302, UBFC, Dijon 21078, France

5. Laboratoire d’Optique et Biosciences, Ecole Polytechnique, CNRS, INSERM, Institut Polytechnique de Paris, 91128 Palaiseau cedex, France

Funder

Agence Nationale de la Recherche

Ministry of Education of the People's Republic of China

European Regional Development Fund

Ministerstvo ?kolstv?, Ml?de?e a Telov?chovy

Grantov? Agentura Cesk? Republiky

Akademie Ved Cesk? Republiky

Nanjing University

European Social Fund

National Natural Science Foundation of China

Faculty of Science, Palack? University

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

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