Barbara Gruza

TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data

Kunal Kumar Jha, Barbara Gruza, Prashant Kumar et al. · Acta Crystallographica Section B Structural Science Crystal Engineering and Materials · 2020 · 49 citations

Refinement of organic crystal structures with multipolar electron scattering factors

Barbara Gruza, Michał Leszek Chodkiewicz, Joanna Krzeszczakowska et al. · Acta Crystallographica Section A Foundations and Advances · 2019 · 39 citations · Full text

X-ray Crystallography, Engineering, Microscopy +24

Extension of the transferable aspherical pseudoatom data bank for the comparison of molecular electrostatic potentials in structure–activity studies

Prashant Kumar, Barbara Gruza, Sławomir A. Bojarowski et al. · Acta Crystallographica Section A Foundations and Advances · 2019 · 37 citations

Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB

Kunal Kumar Jha, Barbara Gruza, Aleksandra Sypko et al. · Journal of Chemical Information and Modeling · 2022 · 29 citations · Full text

Refinements on electron diffraction data of β-glycine in <i>MoPro</i>: a quest for an improved structure model

Kunal Kumar Jha, Barbara Gruza, Michał Leszek Chodkiewicz et al. · Journal of Applied Crystallography · 2021 · 17 citations · Full text

X-ray Crystallography, Crystal Structure, Engineering +18