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Iva Lukac
ORCID
Publication Activity (10 Years)
Years Active: 2017-2021
Publications (10 Years): 3
Top Topics
Geodesic Distance
Mass Spectrometry
Predicting Protein
Drug Discovery
Top Venues
J. Chem. Inf. Model.
J. Comput. Aided Mol. Des.
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Publications
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Joanna Zarnecka
,
Iva Lukac
,
Stephen J. Messham
,
Alhusein Hussin
,
Francesco Coppola
,
Steven J. Enoch
,
Alexander G. Dossetter
,
Edward J. Griffen
,
Andrew Leach
Mapping Ligand-Shape Space for Protein-Ligand Systems: Distinguishing Key-in-Lock and Hand-in-Glove Proteins.
J. Chem. Inf. Model.
61 (4) (2021)
Iva Lukac
,
Paul G. Wyatt
,
Ian H. Gilbert
,
Fabio Zuccotto
Ligand binding: evaluating the contribution of the water molecules network using the Fragment Molecular Orbital method.
J. Comput. Aided Mol. Des.
35 (10) (2021)
Iva Lukac
,
Joanna Zarnecka
,
Edward J. Griffen
,
Alexander G. Dossetter
,
Stephen A. St-Gallay
,
Steven J. Enoch
,
Judith C. Madden
,
Andrew G. Leach
Turbocharging Matched Molecular Pair Analysis: Optimizing the Identification and Analysis of Pairs.
J. Chem. Inf. Model.
57 (10) (2017)