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Linear free energy relationship for the anomeric effect MP2 DFT and ab initio study of 2-substituted-1 4-dioxanes
Integrating docking and molecular dynamics approaches for a series of proline-based 2 5-diketopiperazines as novel aB tubulin inhibitors
Effect of reprocessing on shrinkage and mechanical properties of ABS and investigating the proper blend of virgin and recycled ABS in injection molding
Effect of reprocessing on shrinkage and mechanical properties of ABS and investigating the proper blend of virgin and recycled ABS in injection molding
Ab initio intermolecular potential energy surfaces for the Ar NCCN van der Waals complexes
Synthesis spectroscopy electrochemistry and thermal study of Vanadyl tridentate Schiff base complexes theoretical study of the structures of compounds by ab initio calculations
Ab initio intermolecular potential energy surface of Ne...NCCN van der waals complex effect of the place of midbond function on the interaction
Computational design of Tryprostatin-A derivatives as novel aB tubulin inhibitors
Vibrational spectra and assignments using ab initio and density functional theory analysis on the structure of biotin
MP2 DFT and ab initio calculations on thioxanthone
DFT ab initio NMR and NBO analyses of Na-substituted hydrazino acetamides experimental VS theoretical values
Ab initio and DFT studies of hydrogen bond interactions in difluoroacetic acid dimer
Class-AB Square-Root Domain Filters Based on the Floating Gate MOS Translinear Principle
Ab initio and semiempirical conformational and configurational analysis of N-2-(1 4dioxane)-N -(4-methylbenzenesulfonyl)-O-(4-methylphenoxy)isourea
Ab initio and semiempirical conformational and configurational analysis of N-2-(1 4dioxane)-N -(4-methylbenzenesulfonyl)-O-(4-methylphenoxy)isourea