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Publications by Kenneth M. Merz
Energetics of Zinc-Mediated Interactions in the Allosteric Pathways of Metal Sensor Proteins
Journal of the American Chemical Society
Biochemistry
Colloid
Catalysis
Chemistry
Surface Chemistry
An Efficient Method to Evaluate Intermolecular Interaction Energies in Large Systems Using Overlapping Multicenter ONIOM and the Fragment Molecular Orbital Method
Journal of Physical Chemistry Letters
Materials Science
Nanotechnology
Physical
Theoretical Chemistry
Nanoscience
Trapping Intermediates in Metal Transfer Reactions of the CusCBAF Export Pump of Escherichia Coli
Communications Biology
Genetics
Molecular Biology
Biochemistry
Biological Sciences
Medicine
Agricultural
KECSA-Movable Type Implicit Solvation Model (KMTISM)
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Computational Study of the Resistance Shown by the Subtype B/Hiv-1 Protease to Currently Known Inhibitors
Biochemistry
Biochemistry
Development of the Knowledge-Based and Empirical Combined Scoring Algorithm (KECSA) to Score Protein–Ligand Interactions
Journal of Chemical Information and Modeling
Computer Science Applications
Chemistry
Chemical Engineering
Library
Information Sciences
New Manuscript Type: Application Note
Journal of Chemical Information and Modeling
Computer Science Applications
Chemistry
Chemical Engineering
Library
Information Sciences
Solution NMR Refinement of a Metal Ion Bound Protein Using Metal Ion Inclusive Restrained Molecular Dynamics Methods
Journal of Biomolecular NMR
Biochemistry
Spectroscopy
The Energy Computation Paradox and Ab Initio Protein Folding
PLoS ONE
Multidisciplinary
Assessment of the CCSD and CCSD(T) Coupled-Cluster Methods in Calculating Heats of Formation for Zn Complexes
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
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