International Journal of Quantum ChemistryDOlgov, EY, Batev, VA, Godunov, IA (2004) Int. J. Quant. Chem. 96: pp. 193Dolgov, E. K.; Bataev, V. A.; Godunov, I. A. Structure of the Nitrosomethane Molecule (CH3NO) in the Ground Electronic State: Testing of Ab Initio Methods for ...
A rotational state in chemistry refers to the energy levels associated with the rotation of a molecule, characterized by a rotational quantum number 'J'. The energy of a rotational state is determined by factors such as the rotational constant and moment of inertia of the molecule. You might f...
On a complex PES, an optimization step can displace the molecule from the preceding quadratic region such that the resulting updated approximate Hessian quickly diverges from the true one and thus requires expensive reconstruction12. Even though double- and single-ended interpolation methods such as ...
In order to congregate the prerequisite, novel small molecule based organic luminophores, which proffers every characteristic mentioned above are emerging rapidly [16], [17]. New era of intense research and abundant expansions were conceded out to improve the charge carrier efficiency of red OLEDs...
In recent years, protein-induced fluorescence enhancement (PIFE) has gained popularity as a stand-alone or complementary single-molecule (SM) imaging assay. This popularity mainly stems from its simple labeling requirements involving the use of a single fluorophore1and its ability to measure changes ...
(SS denoting stainless steel) in a frequency range of 107−0.01 Hz at 30–70 °C. Figure3gshows the conductivity varieties of LiTFSI-PEO-xAlF3as a function of AlF3content at different temperatures. The formula of LiTFSI-PEO-0.2AlF3has the highest conductivity, which is 4.63 × 10...
A method of treating cancer or metastasis is provided involving administering at least one oncostatin M (OSM) antagonist to a subject, wherein the subject has been diagnosed with cancer. Administration of an OSM antagonist such as a small molecule pharmaceutical is provided as well as an anti-OS...
The present invention also relates to an N-amino-1,4-dihydroquinoxaline-2,3-dione obtained by reaction of a 1,4-dihydroquinoxaline-2,3-dione of the formula ##STR15## or a tautomer thereof; wherein R is hydrogen; R1 is hydrogen, acylamino, halo, haloalkyl or nitro; ...
1. A porous polyimide film comprising: the porous polyimide film which has a pore distribution width A of 1.15 or less represented by the following formula, an average pore diameter within a range of 0.50 μm to 3.0 μm, an air permeation speed of 30 seconds or less, and a pore circula...
wherein said CRTSA comprises the following structural formula: R1—NH—CH(4-amidinophenyl)-P(═O)(O—)—O—R2 wherein R1 is a peptide sequence of about 5 to about 15 amino acids of an epitope of a target protein antigen for the displayed catalytic antibody, R2 is an electron withdrawi...