Paraskevi Gkeka
10PUBLICATIONS
31CO-AUTHORS
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Publications (10)
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|May 20, 2025
Computational Hit Finding: An Industry Perspective.Paraskevi Gkeka, Fredrik Svensson, Carlos Roca Magadán
|Mar 11, 2025
Harnessing Medicinal Chemical Intuition from Collective Intelligence.Pierre Llompart, Kwame Amaning, Marc Bianciotto
|Jul 08, 2024
Identifying small-molecules binding sites in RNA conformational ensembles with SHAMAN.F P Panei, P Gkeka, M Bonomi
|Jul 11, 2023
Autoencoders for dimensionality reduction in molecular dynamics: Collective variable dimension, biasing, and transition states.Zineb Belkacemi, Marc Bianciotto, Hervé Minoux
|Jul 08, 2022
HARIBOSS: a curated database of RNA-small molecules structures to aid rational drug design.F P Panei, R Torchet, H Ménager
|Apr 18, 2022
Correction to "Phase Diagram of a Stratum Corneum Lipid Mixture".Maren Podewitz, Yin Wang, Paraskevi Gkeka
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Frequent Collaborators
3 joint publications
Marc Bianciotto
2 joint publications
M Bonomi
1 joint publications
F P Panei
1 joint publications
R Torchet
1 joint publications
H Ménager
1 joint publications
Amir Barati Farimani
1 joint publications
Michele Ceriotti
1 joint publications
John D Chodera
1 joint publications
Aaron R Dinner
1 joint publications
Andrew L Ferguson
