MOLGEN 5.0, a Molecular Structure Generator
Research output: Contributions to collected editions/works › Contributions to collected editions/anthologies › Research › peer-review
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MOLGEN 5.0, a Molecular Structure Generator. / Gugisch, Ralf ; Kerber, Adalbert; Kohnert, Axel et al.
Advances in Mathematical Chemistry and Applications. ed. / Subhash C. Basak; Guillermo Restrepo; José L. Villaveces. Vol. 1 Sharjah : Bentham Science Publishers B.V., 2014. p. 113-138 (Advances in Mathematical Chemistry and Applications; Vol. 1).Research output: Contributions to collected editions/works › Contributions to collected editions/anthologies › Research › peer-review
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TY - CHAP
T1 - MOLGEN 5.0, a Molecular Structure Generator
AU - Gugisch, Ralf
AU - Kerber, Adalbert
AU - Kohnert, Axel
AU - Laue, Reinhard
AU - Meringer, Markus
AU - Rücker, Christoph
AU - Wassermann, Alfred
PY - 2014
Y1 - 2014
N2 - MOLGEN 5.x combines the efficiency of the molecular generator MOLGEN 3.5 and the flexibility of MOLGEN 4.x. To achieve this, the software was reimplemented based on a totally new concept. The most visible new features are fuzzy molecular formula input and explicit use of atom state patterns. We describe the version MOLGEN 5.0 of this new series.
AB - MOLGEN 5.x combines the efficiency of the molecular generator MOLGEN 3.5 and the flexibility of MOLGEN 4.x. To achieve this, the software was reimplemented based on a totally new concept. The most visible new features are fuzzy molecular formula input and explicit use of atom state patterns. We describe the version MOLGEN 5.0 of this new series.
KW - Chemistry
KW - MOLGEN
KW - Mathematics
U2 - 10.2174/9781608059287114010010
DO - 10.2174/9781608059287114010010
M3 - Contributions to collected editions/anthologies
SN - 978-1-60805-929-4
VL - 1
T3 - Advances in Mathematical Chemistry and Applications
SP - 113
EP - 138
BT - Advances in Mathematical Chemistry and Applications
A2 - Basak, Subhash C.
A2 - Restrepo, Guillermo
A2 - Villaveces, José L.
PB - Bentham Science Publishers B.V.
CY - Sharjah
ER -