Dataset
Dataset: bche_aa-13_100.nc, 954.02 MB
Access Condition: Open access
Description:
100 ns MD Trajectory for selected biscarbamate in complex with atypical BChE (English)

Documentation: bche_aa-13-top.txt, 3.47 MB
Access Condition: Open access
Description:
Topology of enzyme-ligand (atypical BChE-biscarbamate) system, enabling the visual inspection of MD simulation provided above. (English)

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Cite this document

Barić, D. (2025). Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate [Data set]. https://urn.nsk.hr/urn:nbn:hr:241:727972.

Barić, Danijela. Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate. Institut Ruđer Bošković, 2025. 11 Apr 2025. https://urn.nsk.hr/urn:nbn:hr:241:727972.

Barić, Danijela. 2025. Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate. Institut Ruđer Bošković. https://urn.nsk.hr/urn:nbn:hr:241:727972.

Barić, D. 2025. Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate. Institut Ruđer Bošković. [Online]. [Accessed 11 April 2025]. Available from: https://urn.nsk.hr/urn:nbn:hr:241:727972.

Barić D. Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate. [Internet]. Institut Ruđer Bošković; 2025, [cited 2025 April 11] Available from: https://urn.nsk.hr/urn:nbn:hr:241:727972.

D. Barić, Molecular dynamics simulation of complex of atypical butyrylcholinesterase and piperidine substituted biscarbamate, Institut Ruđer Bošković, 2025. Accessed on: Apr 11, 2025. Available: https://urn.nsk.hr/urn:nbn:hr:241:727972.