Dataset
Dataset: traj_m1b.nc, 956.42 MB
Access Condition: Open access
Description:
100 ns MD Trajectory for resveratrol carbamate derivative in complex with BChE (English)

Documentation: 3djy_nw_ns-m1b-top.txt, 3.47 MB
Access Condition: Open access
Description:
Topology of enzyme-ligand system, enabling the visual inspection of MD simulation provided above. (English)

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Cite this document

Barić, D. (2024). Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative [Data set]. https://urn.nsk.hr/urn:nbn:hr:241:925659.

Barić, Danijela. Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative. Institut Ruđer Bošković, 2024. 02 Apr 2025. https://urn.nsk.hr/urn:nbn:hr:241:925659.

Barić, Danijela. 2024. Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative. Institut Ruđer Bošković. https://urn.nsk.hr/urn:nbn:hr:241:925659.

Barić, D. 2024. Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative. Institut Ruđer Bošković. [Online]. [Accessed 02 April 2025]. Available from: https://urn.nsk.hr/urn:nbn:hr:241:925659.

Barić D. Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative. [Internet]. Institut Ruđer Bošković: Zagreb, HR; 2024, [cited 2025 April 02] Available from: https://urn.nsk.hr/urn:nbn:hr:241:925659.

D. Barić, Molecular dynamics simulation of complex of butyrylcholinesterase and resveratrol carbamate derivative, Institut Ruđer Bošković, 2024. Accessed on: Apr 02, 2025. Available: https://urn.nsk.hr/urn:nbn:hr:241:925659.