Computer-aided design of crystalline drugs.
Resource URI: https://dblp.l3s.de/d2r/resource/publications/conf/hicss/DzyabchenkoA95
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1995
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Computer-aided design of crystalline drugs.
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chemistry computing; chemistry; crystal structure; CAD; optimisation; polymorphism; computer-aided design; crystalline drugs; crystal structure prediction; searching; minimum-energy packings; observed space-group occurrence factors; crystal symmetry; search region; multidimensional crystal-structure parameter space; cell parameters; rigid-body molecular parameters; accelerated convergence method; lattice energy; multi-step structure optimization technique; Packing of Molecules in Crystal; PMC program; implicit symmetry; CRYCOM; crystal comparison program; computational study; crystal structure polymorphism piracetam; metastable form
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Computer-aided design of crystalline drugs.
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