Timothy Clark
0000-0001-7931-4659
Friedrich-Alexander-University Erlangen-Nürnberg
346 papers found
Refreshing results…
Molecular dynamics characterization of the structures and induction mechanisms of a reverse phenotype of the tetracycline receptor
Searching for stable, five-coordinate aquated Al(III) species. Water exchange mechanism and effect of pH
Investigating protein-protein and protein-ligand interactions by molecular dynamics simulations
Principle and mechanism of direct porphyrin metalation: joint experimental and theoretical investigation
SCRF-DFT and NMR Comparison of Tetracycline and 5a,6-Anhydrotetracycline in Solution
Nitrite Impurities Are Responsible for the Reaction Observed between Vitamin B12and Nitric Oxide in Acidic Aqueous Solution
Multipole electrostatic potential derived atomic charges in NDDO-methods with spd-basis sets
Formation and Reactivity of Silacyclopropenes Derived from Siloxyalkynes: Stereoselective Formation of 1,2,4-Triols
Lithium Cation as Radical-Polymerization Catalyst
A Rhenium–Cyclohexane Complex with Preferential Binding of Axial CH Bonds: A Probe into the Relative Ability of CH, CD, and CC Bonds as Hyperconjugative Electron Donors?
Molecular Dynamics Simulations of the Tetracycline-repressor Protein: The Mechanism of Induction
Structural Changes and Binding Characteristics of the Tetracycline-Repressor Binding Site on Induction
The structure of 5a,6–anhydrotetracycline and its Mg2+ complexes in aqueous solution
The formation of endo-complexes between calixarenes and amines—a reinvestigation
Simulating FRET from Tryptophan: Is the Rotamer Model Correct?
In Silico Prediction of Buffer Solubility Based on Quantum-Mechanical and HQSAR- and Topology-Based Descriptors
Tuning electron transfer through p-phenyleneethynylene molecular wires
Dispersion treatment for NDDO-based semiempirical MO techniques
o-iodoxybenzoic acid (IBX): pK(a) and proton-affinity analysis
The ethylene/metal(0) and ethylene/metal(I) redox system: model ab initio calculations
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