Author

Ksenia Kolomeisky

Center for Theoretical Biological Physics

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

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Biochemistry· 1

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Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Approach:statistical model· 1

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Anatoly B. KolomeiskyiD· 1 shared Angela MedvedevaiD· 1 shared

Activity by Year

2026-2026 · peak 1/yr

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1 shared paperBiochemistry

Anatoly B. KolomeiskyORCID

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1 paper

Recent·Most cited

BiochemistryThe Journal of Chemical PhysicsPeer-reviewedJan 15, 2026

Physical-Chemical Approach to Identify Local Structural Determinants of Molecular Mechanisms: Case Study of Antimalarial Drug Pyronaridine and Crystal-Growth Inhibition

Angela Medvedeva, Ksenia Kolomeisky, Anatoly B. Kolomeisky

The paper develops a physical-chemical framework to identify fragment-level structural determinants of molecular mechanisms, applying it to pyronaridine's crystal-growth inhibition and antimalarial activity.

DOI 10.1063/5.0308064

deep learningstatistical model

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