Alina Emelianova

7PUBLICATIONS
9CO-AUTHORS
Theory and design of materialsComputational chemistryBiomolecular modelling and designChemical thermodynamics and energeticsWastewater treatment processes
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Publications (7)

|Mar 23, 2026
Modeling biomolecular condensates across scales: Atomistic, coarse-grained, and data-driven approaches.

Maria Julia Maristany, Alina Emelianova, Pin Yu Chew

|Jan 13, 2026
Correction to "Force Fields for Molecular Modeling of Sarin and its Simulants: DMMP and DIMP".

Alina Emelianova, Elizaveta A Basharova, Andrei L Kolesnikov

|Aug 01, 2025
Prediction of Small-Molecule Partitioning into Biomolecular Condensates from Simulation.

Alina Emelianova, Pablo L Garcia, Daniel Tan

|Mar 17, 2025
Prediction of small-molecule partitioning into biomolecular condensates from simulation.

Alina Emelianova, Pablo L Garcia, Daniel Tan

|Aug 04, 2023
Adsorption-Induced Deformation of Zeolites 4A and 13X: Experimental and Molecular Simulation Study.

Alina Emelianova, Christian Balzer, Gudrun Reichenauer

|Mar 28, 2023
Closer Look at Adsorption of Sarin and Simulants on Metal-Organic Frameworks.

Alina Emelianova, Allen Reed, Elizaveta A Basharova

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