"Preventing lipophilic aggregation in cosolvent molecular dynamics ..."

Olivier Beyens, Hans De Winter (2024)

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DOI: 10.1186/S13321-024-00819-Y

access: open

type: Journal Article

metadata version: 2024-05-07

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Olivier Beyens, Hans De Winter:
Preventing lipophilic aggregation in cosolvent molecular dynamics simulations with hydrophobic probes using Plumed Automatic Restraining Tool (PART). J. Cheminformatics 16(1): 23 (2024)

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