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Updated: Nov 2, 2025

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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VoroContacts: a tool for the analysis of interatomic contacts in macromolecular structures

Kliment Olechnovič1, Česlovas Venclovas1

  • 1Institute of Biotechnology, Life Sciences Center, Vilnius University, Vilnius LT-10257, Lithuania.

Bioinformatics (Oxford, England)
|June 16, 2021
PubMed
Abstract

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