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Internal Coordinate Mechanics

Known as: ICM 
ICM stands for Internal Coordinate Mechanics and was first designed and built to predict low energy conformations of molecules by sampling the space… 
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Papers overview

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2010
2010
Human lipoxygenases (LOX) play important roles in the biosynthesis of leukotrienes which contribute to inflammation in asthma and… 
2010
2010
Lipoxygenases (LOX) play important roles in the biosynthesis of biologically active eicosanoids form polyunsaturated fatty acids… 
2009
2009
Although there is no absolutely precise method for charge determination, QM methods are considered to be sufficiently accurate… 
2009
2009
A novel series of 1,3-diarylpyrazole derivatives (4–8), analogues to lonazolac, were designed, synthesized, and evaluated for… 
2008
2008
In the present study, flexible ligand docking and multiple scoring were used to study the binding of long-chain fatty acid (LCFAs… 
2006
2006
Cytochromes P450 (P450) 2B6 and 3A5 are inactivated by bergamottin (BG). P450 2B6 metabolized BG primarily to M3 and M4 and one… 
Review
2005
Review
2005
Computational ligand docking and screening is widely employed throughout the pharmaceutical industry to speed up the drug… 
2002
2002
Large scale discovery of new human genes, gene families and isozymes creates an exciting biomedical opportunity. Advanced… 
1996
1996
Environmental problems are generally regarded as being systemic in nature, yet few systemic management techniques are used in… 
1994
1994
An efficient algorithm for parallelization of a molecular mechanics program operating in the space of internal coordinates such…