where x is the vector of concentrations, N is the stoichiometric matrix with elements νli, and ξ is the vector of independent extends [13]. Then the vector of generalized thermodynamic fluxes J will be (1.31)J
While primarily focusing on the establishment of a systematic nomenclature and symbols for elements of atomic number greater than 100, a specific 1979 IUPAC recommendation [6] stated: “The existence of a systematic nomenclature for the unknown elements does not deny the right of 'discoverers' of...
A chemical equation is a symbolic representation of a chemical reaction in the form of symbols and formulas, wherein the reactant entities are given on the left-hand side and the product entities on the right-hand side. A balanced equation is an equation for a chemical reaction in which ...
Yet another advantage of the polyBERT approach is its coverage of the entire chemical space. Molecule SMILES strings are a subset of polymer SMILES strings and differ by only two stars ([*]) symbols that indicate the two endpoints of the polymer repeat unit. polyBERT has no intrinsic limitati...
wavelength, marked at the right top of the figure by the symbols 1 to 6. If a straight line is obtained one calls the type of the reaction a uniform one. The straight line is formally obtained according to: (37)E1(t)=ɛ1A⋅a(t)⋅d+ɛ1B⋅b(t)⋅d=(ɛ1A−ɛ1B)...
The role of sponsors, if any, should be declared in relation to the study design, collection, analysis and interpretation of data, writing of the report and decision to submit the article for publication. If funding sources had no such involvement this should be stated in your submission. ...
Special symbols like ' =' and '-' represent double and single bonds, respectively [25]. Table 1 illustrates some examples of chemicals, their chemical formulas, and their SMILES representation. 2.3 Feature extraction Molecular descriptors and fingerprints are pivotal elements within quantitative ...
Background: The purpose of the research and the question addressed should be stated briefly. Methods: The main methods that used in this research should be described. Significant Findings: The principal results and major conclusions should be summarized. An abstract is often presented se...
Atoms are represented by their atomic symbols. Hydrogen atoms saturating free valences are not represented explicitly. 2. Neighboring atoms stand next to each other, and bonds are characterized as being single (-), double ( =), triple (#), or aromatic (:). Single and aromatic bonds are...
Background: The purpose of the research and the question addressed should be stated briefly. Methods: The main methods that used in this research should be described. Significant Findings: The principal results and major conclusions should be summarized. An abstract is often presented ...