Projects funded by the NCN


Information on the principal investigator and host institution

Information of the project and the call

Keywords

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Optimization of coarse-grained molecular dynamics simulations for tunnel exploration of large proteins with buried active sites leveraging an encouraging speed-accuracy compromise

2023/49/N/NZ2/02567

Keywords:

Coarse-grained simulations tunnels ligand transport protein dynamics transient pathways enzyme function molecular gates

Descriptors:

  • NZ2_8: Computational biology
  • NZ2_10: Biological systems analysis, modelling and simulation

Panel:

NZ2 - Genetics, genomics: molecular genetics, genomics, proteomics, bioinformatics, systems biology, genetic epidemiology

Host institution :

Uniwersytet im. Adama Mickiewicza w Poznaniu, Wydział Biologii

woj. wielkopolskie

Other projects carried out by the institution 

Principal investigator (from the host institution):

Nishita Mandal 

Number of co-investigators in the project: 2

Call: PRELUDIUM 22 - announced on 2023-03-16

Amount awarded: 45 097 PLN

Project start date (Y-m-d): 2024-01-09

Project end date (Y-m-d): 2025-01-08

Project duration:: 12 months (the same as in the proposal)

Project status: Pending project

Project description

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Note - project descriptions were prepared by the authors of the applications themselves and placed in the system in an unchanged form.