Understanding and manipulating the conformational behavior of a molecule in different solvent environments ... over the RMSE values is at most 0.05 kJ mol –1 nm –1). Hence, one model was selected for ...

Department of Chemistry and Biochemistry, George Mason University, Fairfax, Virginia 22030, United States Center for Molecular Engineering, George Mason University, Manassas, Virginia 20110, United ...

However, the rationale of these interactions with their catalytic performance of SACs in nature and a unified theoretical model to describe ... introduced the frontier molecular orbital (FMO ...

Royalty-free licenses let you pay once to use copyrighted images and video clips in personal and commercial projects on an ongoing basis without requiring additional payments each time you use that ...

Most of the metabolites were amino acids and associated metabolites, benzene and substituted derivatives ... with maximum interincisal opening. A model was constructed to diagnose TMJOA grade and nine ...

Kathleen Lonsdale got in on the ground floor of X-ray crystallography soon after its discovery in the early 20th century, and used it to prove conclusively that the benzene molecule is a flat ...

The proposed Raman algorithms directly link to the molecular composition of grains and allow fast ... Ziegler and Patel have previously proposed Raman barcodes (71). Unlike the model of barcode put ...