Literature DB >> 3199152

An investigation into the construction of molecular models by the template joining method.

A R Leach1, K Prout, D P Dolata.   

Abstract

The results of a wide-ranging investigation into some of the different methods available for performing the 'joining' of templates to build molecular models show that the choice of algorithm can significantly affect the quality of the results obtained, and different algorithms are most suited to particular categories of join.

Mesh：

Year:  1988        PMID： 3199152     DOI： 10.1007/bf01532086

Source DB:  PubMed          Journal:  J Comput Aided Mol Des        ISSN： 0920-654X            Impact factor:   3.686


  1 in total

1.  WIZARD: AI in conformational analysis.

Authors:  D P Dolata; A R Leach; K Prout
Journal:  J Comput Aided Mol Des       Date:  1987-04       Impact factor: 3.686
  1 in total
  5 in total

1.  Automated conformational analysis: algorithms for the efficient construction of low-energy conformations.

Authors:  A R Leach; K Prout; D P Dolata
Journal:  J Comput Aided Mol Des       Date:  1990-09       Impact factor: 3.686

2.  BUILDER v.2: improving the chemistry of a de novo design strategy.

Authors:  D C Roe; I D Kuntz
Journal:  J Comput Aided Mol Des       Date:  1995-06       Impact factor: 3.686

Review 3.  Current methods for site-directed structure generation.

Authors:  R A Lewis; A R Leach
Journal:  J Comput Aided Mol Des       Date:  1994-08       Impact factor: 3.686

4.  A fast and efficient method to generate biologically relevant conformations.

Authors:  G Klebe; T Mietzner
Journal:  J Comput Aided Mol Des       Date:  1994-10       Impact factor: 3.686

5.  Constitutional, configurational and conformational analysis of transition metal coordination complexes.

Authors:  A R Leach
Journal:  J Comput Aided Mol Des       Date:  1993-04       Impact factor: 3.686
  5 in total

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