Jan Řezáč
0000-0001-6849-7314
3 papers found
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Erratum: “DFTB+, a software package for efficient approximate density functional theory based atomistic simulations” [J. Chem. Phys. 152, 124101 (2020)]
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations
Superior Performance of the SQM/COSMO Scoring Functions in Native Pose Recognition of Diverse Protein–Ligand Complexes in Cognate Docking
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