Last Modified

   1 January 2020

Theoretical Organic Chemistry Nuclear Receptor Chemistry Structural Bioinformatics Rational Drug Design

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Molecular Modeling and Structure-based Drug Design Systems


ab initio 3D Modeling


The "ab initio 3D Modeling" program carries out a novel algorithm for secondary structure prediction (see example).

This program supports many types of structural optimizations and clustering functions.

ab initio 3D Modeling Program


November 2002



The Homology Modeling Professional module program in Homology Modeling Professional for HyperChem software can carry out this ab initio 3D modeling algorithm.



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