MOLecular Structure GENeration with MOLGEN, new features and future developments (1997)


Download Links

by C. Benecke , T. Grüner , A. Kerber , R. Laue , T. Wieland
Venue:Fresenius J. Anal. Chem
Citations:6 - 4 self

Documents Related by Co-Citation

6 Molecules in Silico: The Generation of Structural Formulae and its Applications – Adalbert Kerber, Reinhard Laue, Markus Meringer, Christoph Rücker
8 MOLGEN–CID, A Canonizer for Molecules and Graphs Accessible through the Internet – Joachim Braun, Ralf Gugisch, Adalbert Kerber, Reinhard Laue, Markus Meringer, Christoph Rücker - 2004
6 MOLGEN–QSPR, a Software Package for the Search of Quantitativ Structure Property Relationships – A Kerber, R Laue, M Meringer, C Rücker - 2004
7 MOLGEN-MS: Evaluation of Low Resolution Electron Impact Mass Spectra with MS Classification and Exhaustive Structure Generation – A. Kerber, R. Laue, M. Meringer, K. Varmuza
10 MOLGEN+, a generator of connectivity isomers and stereoisomers for molecular structure elucidation – C BENECKE, R GRUND, R HOHBERGER, A KERBER, R LAUE, T WIELAND - 1995
4 Mathematische Modelle für die kombinatorische Chemie und die molekulare Strukturaufklärung – M Meringer - 2004
9 Orderly algorithms for generating restricted classes of graphs – C J Colbourn, R C Read - 1979
5 Everyone a Winner – R C Read - 1978
10 Mass Spectral Classifiers for Supporting Systematic Structure Elucidation – K Varmuza, W Werther - 1996
4 Prediction of Mass Spectra from Structural – J Gasteiger, W Hanebeck, K-P Schulz - 1992
3 Automatic Analysis and Simulation of Mass Spectra – J Gasteiger, W Hanebeck, K-P Schulz, S Bauerschmidt, R Höllering - 1993
3 The use of MS classifiers and structure generation to assist in the identification of unknowns in effect–directed analysis – E L Schymanski, C Meinert, M Meringer, W Brack
2 MS/MS data improves automated determination of molecular formulas by mass spectrometry – M Meringer, S Reinker, J Zhang, A Muller
2 MOLGEN 5.0, a Molecular Structure Generator – R Gugisch, A Kerber, A Kohnert, R Laue, M Meringer, C Rücker, A Wassermann - 2013
8 2010) In silico fragmentation for computer assisted identification of metabolite mass spectra – S Wolf
1 Molgen 4.0 – T Grüner, A Kerber, R Laue, M Meringer - 1998
4 MOLGEN-COMB, a software package for combinatorial chemistry – R Gugisch, A Kerber, R Laue, M Meringer, J Weidinger - 2000
4 Use of markush structure techniques to avoid enumeration in diversity analysis of large combinatorial libraries – J M Barnard, G M Downs
1 MNDO Method of Studies of Isomers of C6H6 – J Jeevanandam, R Gopalan - 1996