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Chemoinformatics for Astrobiology: The Generation of Structural Formulas and Its Applications

Meringer, Markus (2014) Chemoinformatics for Astrobiology: The Generation of Structural Formulas and Its Applications. ELSI Seminar, 08 Apr 2014, Tokyo, Japan.

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Official URL: http://old.elsi.jp/ja/activity/seminar/elsi-seminar/

Abstract

Chemoinformatics is the interdisciplinary scientific field that develops computational methods for processing chemical data. Structure generation techniques offer unique ways to systematically create molecules ‘in silico’ that are not (yet) present in any database. This talk will give a survey of the most important ideas and methods underlying such structure generation algorithms. Starting from a brief historical overview, including typical applications of structure generators, I will conclude with an outline of current projects and plans that might pave the way towards a better understanding of the biochemical foundations of life's origins.

Item URL in elib:https://elib.dlr.de/88900/
Document Type:Conference or Workshop Item (Speech)
Title:Chemoinformatics for Astrobiology: The Generation of Structural Formulas and Its Applications
Authors:
AuthorsInstitution or Email of AuthorsAuthors ORCID iD
Meringer, MarkusMarkus.Meringer (at) dlr.deUNSPECIFIED
Date:2014
Refereed publication:No
Open Access:No
Gold Open Access:No
In SCOPUS:No
In ISI Web of Science:No
Status:Published
Keywords:structure generation algorithms, constitutional isomers, virtual chemical compound libraries, origin of life
Event Title:ELSI Seminar
Event Location:Tokyo, Japan
Event Type:international Conference
Event Dates:08 Apr 2014
Organizer:Earth-Life Science Institute, Tokyo Institute of Technology
HGF - Research field:Aeronautics, Space and Transport
HGF - Program:Space
HGF - Program Themes:Earth Observation
DLR - Research area:Raumfahrt
DLR - Program:R EO - Erdbeobachtung
DLR - Research theme (Project):R - Vorhaben Entwicklung von Atmosphärenprozessoren (old)
Location: Oberpfaffenhofen
Institutes and Institutions:Remote Sensing Technology Institute > Atmospheric Processors
Deposited By: Meringer, Dr.rer.nat. Markus
Deposited On:23 Apr 2014 13:44
Last Modified:30 Apr 2014 17:56

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