Only in current section. PyMOMO is a version of the MOMO force field for the "Molecular Modelling Toolkit" by Konrad Hinsen (see http:/ sourcesup.cru.fr/projects/mmtk/. PyMOMO is a library for the Python programming language. I created the software for my doctoral thesis, which deals with automatic force field parameterization.
http://www.pymomo.de/
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Welcome to PyMOMO — PyMOMO | pymomo.de Reviews
https://pymomo.de
Only in current section. PyMOMO is a version of the MOMO force field for the "Molecular Modelling Toolkit" by Konrad Hinsen (see http:/ sourcesup.cru.fr/projects/mmtk/. PyMOMO is a library for the Python programming language. I created the software for my doctoral thesis, which deals with automatic force field parameterization.
pymomo.de
PyMOMO
http://www.pymomo.de/accessibility-info
Only in current section. This site uses the Open Source Content Management System Plone. And has been designed to be completely accessible and usable, working in accordance with the Web Content Accessibility Guidelines (. V10) If there is anything on this site — accessibility or validation related — that is not according to the standard, please contact the Site Administration. And not the Plone Team. Access keys are a navigation device enabling you to get around this web site using your keyboard. Are sub...
PyMOMO - documentation and applications — PyMOMO
http://www.pymomo.de/documentation-and-applications
Only in current section. PyMOMO - documentation and applications. PyMOMO documentation and examples for applications. PyMOMO is a library for the Python programming language, which implements the MOMO force field. It depends on Konrad Hinsen's Molecular Modelling Toolkit and some other libraries. I created the software for my doctoral thesis, which deals with automatic force field parameterization. 2] http:/ web.uni-frankfurt.de/fb14/ak egert/.
Imprint — PyMOMO
http://www.pymomo.de/imprint
Only in current section. Institut für Organische Chemie und Chemische Biologie. 60438 Frankfurt am Main. Telephone: 49 69 798 29232.
Downloads — PyMOMO
http://www.pymomo.de/downloads
Only in current section. Improvements: can load parameters from pickle-file, no more seperate eval.py for SM-charges, check if pi-systems and charges need to be reevaluated Bugs fixed: slow ff initialisation because of error in the small ring detection; wrong index in pi-bondorder matrix in some cases. Version 2.7.1 of MMTK definitions for bromine and iodine modified conjugate gradients minimizer (checks for infinite shifts and zero shifts). Bugfix in universe.writeXML() support. PyMOMO 0.0.7. Patched ve...
PyMOMO
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Welcome to PyMOMO — PyMOMO
Only in current section. PyMOMO is a version of the MOMO force field for the "Molecular Modelling Toolkit" by Konrad Hinsen (see http:/ sourcesup.cru.fr/projects/mmtk/. PyMOMO is a library for the Python programming language. I created the software for my doctoral thesis, which deals with automatic force field parameterization.
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