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SAM1

SAM1, or "Semiempirical ab initio Model 1", is a semiempirical quantum chemistry method for computing molecular properties. It is an implementation… 
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AMPACAustin Model 1Computational chemistryMNDO

Papers overview

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2014
2014
Estudo teórico sobre armazenagem e estabilidade de gases em nanoestruturas de Carbono
O estudo atual de nanoestruturas de carbono, dentre as quais se podem citar as buckyballs e os nanotubos de carbono, tem gerado… 
2010
2010
Optimization of shoot apex based cotton regeneration system
Cotton (Gossypium spp.) belonging to the genus Gossypium in the family Malvaceae. Cotton is an important fibre crop of global… 
2009
2009
Ekaterina Garmash Meanings of “sam1”
First of all, sam1 doesn’t seem to have any at-issue meanings: the truth-conditions of sentences (1)-(4) will stay the same if we… 
2009
2009
Hydrophobic self-assembly monolayer structure for reduction of interfacial moisture diffusion
Interfacial delamination is one of the primary concerns in electronic package design. Pop-corning during the solder reflow of… 
2003
2003
C94 IPR isomeric set: large-scale computations of relative stabilities based on the Gibbs function
Review
2000
Review
2000
Computations on the IPR isomers of C88 and C90
2000
2000
Structure-Function Analysis of Yeast mRNA Cap Methyltransferase and High-Copy Suppression of Conditional Mutants by AdoMet Synthase and the Ubiquitin Conjugating Enzyme Cdc 34 p
Here we present a genetic analysis of the yeast cap-methylating enzyme Abd1p. To identify individual amino acids required for… 
1999
1999
An Implementation of Configuration Interaction in a General Purpose Semiempirical Context
We illustrate here an efficient approach to the implementation of configuration interaction (CI) methodologies in the case of… 
1994
1994
SAM1 Semiempirical Parameters
Abstract : Elemental parameter sets have been completely developed and validated for sulfur (S), silicon (Si), and phosphorous (P… 
Review
1994
Review
1994
Ampac 4.5
AMPAC 4.5 is the latest commercial version of software originally developed in the Dewar group for general purpose semiempirical… 
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