Hector Martinez-Seara

Všechny publikace

Nejnovější publikace

Compounds mimicking the Michaelis-Menten transition state of the phosphatidylinositol 4-kinase

H. Hřebabecký M. Klíma M. Dejmek P. Krupa M. Riopedre Fernández E. Dávidová J. Benýšek H. Martinez-Seara B. Rozycki E. Bouřa R. Nencka

Bioorganic & Medicinal Chemistry 139: 118666 (2026)

Bayesian Learning for Accurate and Robust Biomolecular Force Fields

V. Košťál B. Shanks P. Jungwirth H. Martinez-Seara

Journal of Chemical Theory and Computation 22 (5): 2652–2663 (2026)

Transient formation of supramolecular complexes between hyaluronan and oligopeptides at submicromolar concentration

M. Riopedre Fernández B. Chu A. Kuffel A. Marchioro D. Biriukov H. Martinez-Seara

Communications Chemistry 9: 34 (2026)

Why good quality water models have a surprisingly wide range of dielectric constants

V. Cruces Chamorro P. Jungwirth H. Martinez-Seara

Journal of Chemical Physics 163: 194106 (2025)