Jonathan M. Goodman
0000-0002-8693-9136
163 papers found
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RInChIs and reactions
Structure–activity studies of the pelorusides: new congeners and semi-synthetic analogues
Self-assembly of trehalose molecules on a lysozyme surface: the broken glass hypothesis
How reliable are DFT transition structures? Comparison of GGA, hybrid-meta-GGA and meta-GGA functionals
Combining calculations and experiments in the analysis of NMR spectra: CP3, DP4 and beyond
Proline-catalyzed aldol reactions of cyclic diketones: fluorine modifies pathways as well as transition states
Assigning Stereochemistry to Single Diastereoisomers by GIAO NMR Calculation: The DP4 Probability
The stereochemical assignment of acyclic polyols: a computational study of the NMR data of a library of stereopentad sequences from polyketide natural products
DFT Study on the Factors Determining the Enantioselectivity of Friedel−Crafts Reactions of Indole withN-Acyl andN-Tosylimines Catalyzed by BINOL−Phosphoric Acid Derivatives
Chemistry: Computation, synthesis and communication
Synthetic and computational studies on the tricarboxylate core of 6,7-dideoxysqualestatin H5 involving a carbonyl ylide cycloaddition-rearrangement.
Enzyme Catalysis by Hydrogen Bonds: The Balance between Transition State Binding and Substrate Binding in Oxyanion Holes
To Switch or Not To Switch: The Effects of Potassium and Sodium Ions on α-Poly- l -glutamate Conformations in Aqueous Solutions
Conformational changes of trialanine in sodium halide solutions: An in silico study
Assigning the Stereochemistry of Pairs of Diastereoisomers Using GIAO NMR Shift Calculation
Mechanism of BINOL−Phosphoric Acid-Catalyzed Strecker Reaction of Benzyl Imines
Hydrogen Bonding and π-Stacking: How Reliable are Force Fields? A Critical Evaluation of Force Field Descriptions of Nonbonded Interactions
Synthetic Studies on Siphonariid Polypropionates: Synthesis and Isomerization of the Caloundrin B Trioxaadamantane Ring System
A route to enantiomerically pure 5-(2′-hydroxyethyl)cyclopent-2-en-1-ol and its absolute configuration by Mosher esters
Findings of the Challenge To Predict Aqueous Solubility
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