NSC3046

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NSC3046

dc.contributor Andrew McLean
dc.contributor Henry S. Rzepa
dc.contributor James J. P. Stewart
dc.contributor Peter Murray-Rust
dc.contributor Matthew J. Harvey
dc.contributor Nicholas Mason
dc.creator Imperial College High Performance Computing Service
dc.date.accessioned 2015-01-16T03:42:18Z
dc.date.available 2015-01-16T03:42:18Z
dc.date.issued 2015-01-16
dc.identifier 10.1007/s00894-005-0278-1
dc.identifier.uri http://hdl.handle.net/10042/187539
dc.identifier.uri http://dx.doi.org/10.14469/ch/183816
dc.format.mimetype chemical/x-cml
dc.publisher Unilever Center for Molecular Informatics, Cambridge University
dc.rights Creative Commons Public Domain Dedication
dc.title NSC3046
dc.type NSC3046
dc.date.updated 2015-01-16T03:42:19Z


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NCI.xml 4.581Kb chemical/x-cml View/Open
PM5.xml 4.551Kb chemical/x-cml View/Open
PM7.xml 15.43Kb chemical/x-cml View/Open
MOPAC-PM7.in 1.814Kb chemical/x-mopac-input View/Open
MOPAC-PM7.out 24.78Kb chemical/x-mopac-output View/Open
MOPAC-PM7.arc 3.780Kb chemical/x-mopac-arc View/Open

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