Jan Řezáč
Czech Academy of Sciences(CZ)Institute of Organic Chemistry(PL)Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry(CZ)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Crystallography and molecular interactions, Protein Structure and Dynamics, Spectroscopy and Quantum Chemical Studies, Computational Drug Discovery Methods
Most-Cited Works
- → DFTB+, a software package for efficient approximate density functional theory based atomistic simulations(2020)1,112 cited
- → S66: A Well-balanced Database of Benchmark Interaction Energies Relevant to Biomolecular Structures(2011)988 cited
- → Advanced Corrections of Hydrogen Bonding and Dispersion for Semiempirical Quantum Mechanical Methods(2011)530 cited
- → Benchmark Calculations of Interaction Energies in Noncovalent Complexes and Their Applications(2016)470 cited
- → Describing Noncovalent Interactions beyond the Common Approximations: How Accurate Is the “Gold Standard,” CCSD(T) at the Complete Basis Set Limit?(2013)468 cited
- → Halogen bond tunability I: the effects of aromatic fluorine substitution on the strengths of halogen-bonding interactions involving chlorine, bromine, and iodine(2011)400 cited