semiempirical mo theory
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Green's Function Ionization Potentials in Semiempirical MO Theory

Encyclopedia of Computational Chemistry ◽

10.1002/0470845015.cga009 ◽

2002 ◽

Author(s):

David Danovich

Keyword(s):

Green’S Function ◽

Green's Function ◽

Ionization Potentials ◽

Semiempirical Mo Theory ◽

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Some Biological Applications of Semiempirical MO Theory

3D QSAR in Drug Design ◽

10.1007/0-306-46857-3_8 ◽

2002 ◽

pp. 131-159 ◽

Author(s):

Bernd Beck ◽

Timothy Clark

Keyword(s):

Biological Applications ◽

Semiempirical Mo Theory ◽

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On the performance of semiempirical MO theory for dipole moments of dye molecules

Journal of Molecular Modeling ◽

10.1007/s00894-001-0052-y ◽

2001 ◽

Vol 7 (10) ◽

pp. 384-391 ◽

Author(s):

Alexandr V. Yatsenko ◽

Ksenia A. Paseshnichenko

Keyword(s):

Dipole Moments ◽

Dye Molecules ◽

Semiempirical Mo Theory ◽

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Quo Vadis semiempirical MO-theory?

Journal of Molecular Structure THEOCHEM ◽

10.1016/s0166-1280(00)00581-9 ◽

2000 ◽

Vol 530 (1-2) ◽

pp. 1-10 ◽

Author(s):

T Clark

Keyword(s):

Semiempirical Mo Theory ◽

Quo Vadis ◽

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Is it possible to create a better semiempirical mo theory ?

Tetrahedron ◽

10.1016/s0040-4020(01)86240-2 ◽

1988 ◽

Vol 44 (24) ◽

pp. 7461-7464 ◽

Author(s):

Einar Lindholm

Keyword(s):

Semiempirical Mo Theory ◽

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