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Publications by Pavel Hobza

In My Element : Hydrogen

Chemistry - A European Journal
Organic ChemistryCatalysisChemistry
2018English

An Isolated Molecule of Iron(II) Phthalocyanine Exhibits Quintet Ground-State: A Nexus Between Theory and Experiment

Chemistry - A European Journal
Organic ChemistryCatalysisChemistry
2018English

Impressive Enrichment of Semiempirical Quantum Mechanics‐Based Scoring Function: HSP90 Protein With 4541 Inhibitors and Decoys

ChemPhysChem
Theoretical ChemistryPhysicalOpticsAtomicMolecular Physics,
2019English

Impressive Enrichment of Semiempirical Quantum Mechanics‐Based Scoring Function: HSP90 Protein With 4541 Inhibitors and Decoys

ChemPhysChem
Theoretical ChemistryPhysicalOpticsAtomicMolecular Physics,
2019English

Sequential BN-doping Induced Tuning of Electronic Properties in Zigzag-Edged Graphene Nanoribbons: A Computational Approach

RSC Advances
ChemistryChemical Engineering
2018English

Understanding the Spin-Dependent Electronic Properties of Symmetrically Far-Edge Doped Zigzag Graphene Nanoribbon From a First Principles Study

RSC Advances
ChemistryChemical Engineering
2017English

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