Total results: 143
The Chemical Terms Evaluator is a command line application designed to evaluate mathematical expressions on molecules.
The Evaluator class provides an interface to the Chemical Terms library. It requires the creation of a ChemJEP object.
Evaluate Chemical Terms expression * * For API example see * https://chemaxon.com/jchem/doc/dev/java/api/chemaxon/jep/Evaluator.html * * Usage: * 1.
Evaluator and JChem Cartridge Examples. Chemical Terms Evaluator and Chemical Terms - JChem Cartridge examples (molecule context). The examples are divided ...
These examples refer to a molecule context and applies the Chemical Terms Evaluator command line tool and chemical expression evaluation and filtering in JChem ...
... Evaluator evaluator = new Evaluator() chemJEP = evaluator.compile("pKa('acidic','1')", MolContext.class) MolContext context = new MolContext() context ...
an expression string evaluated by the command line version of Evaluator ... evaluators and min-max evaluators). a reaction condition can refer to a reactant ...
xml configuration file. Create your own instance of the evaluator.xml file in the MarvinBeans/config directory (see the Evaluator manual for alternative ...
evaluator functions : functions containing an inner expression string as parameter - evaluate this expression for each atom in an atom context, examples ...
Evaluator and JChem Cartridge Examples (molecule context). Reactor Examples CT (reaction context). Search Filter Examples (search context). These examples use ...