Objetivo
TO DEVELOP ADVANCED SOFTWARE SYSTEMS FOR THE MANAGEMENT OF DATA-BASES ON ENVIRONMENTAL CHEMICALS.
AN UNAMBIGUOUS, HIERARCHICAL CODING OF CHEMICAL REACTIONS IS DEVELOPED. IT IS STRUCTURED INTO (A) BOND CHANGES, (B) REACTION-INVARIANT BONDS IN THE COMMON REACTION CORE OF REACTANTS AND PRODUCTS, (C) CHEMICAL ELEMENT NAMES IN REACTION CORE, (D) ENVIRONMENTAL SPHERES OF EACH ATOM IN REACTION CORE.
A UNIQUE (CANONICAL) REPRESENTATION OF THESE FEATURES CAN BE TRANSFORMED INTO A STRING NOTATION SUITABLE FOR MANIPULATION BY CONVENTIONAL DATA BASE MANAGEMENT SYSTEMS. DATA STRUCTURES AND ACCESS METHODS WILL BE DEVELOPED AND IMPLEMENTED FOR INCORPORATION OF A REACTION I&D-MODULE IN A RELATIONAL DBMS (ADABAS).
METHODS FOR COMPUTER-GUIDED UPGRADING AND INCORPORATION OF EXISTING REACTION DATA, BOTH FROM ECDIN AND FROM OTHER DATA SERVICES WILL BE INVESTIGATED.
Tema(s)
Data not availableConvocatoria de propuestas
Data not availableRégimen de financiación
CSC - Cost-sharing contractsCoordinador
85350 FREISING
Alemania