Literature DB >> 4830256

Substructural analysis. A novel approach to the problem of drug design.

R D Cramer, G Redl, C E Berkoff.   

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Year:  1974        PMID： 4830256     DOI： 10.1021/jm00251a014

Source DB:  PubMed          Journal:  J Med Chem        ISSN： 0022-2623            Impact factor:   7.446


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  11 in total

1.  High-affinity interactions of ligands at recombinant guinea pig 5HT7 receptors.

Authors:  R E Wilcox; J E Ragan; R S Pearlman; M Y Brusniak; R M Eglen; D W Bonhaus; T E Tenner; J D Miller
Journal:  J Comput Aided Mol Des       Date:  2001-10       Impact factor: 3.686

2.  The Compressed Feature Matrix--a novel descriptor for adaptive similarity search.

Authors:  S F Badreddin Abolmaali; Claude Ostermann; Andreas Zell
Journal:  J Mol Model       Date:  2003-02-05       Impact factor: 1.810

3.  Tautomers and topomers: challenging the uncertainties of direct physicochemical modeling.

Authors:  Richard D Cramer
Journal:  J Comput Aided Mol Des       Date:  2010-03-21       Impact factor: 3.686

Review 4.  Evaluation of machine-learning methods for ligand-based virtual screening.

Authors:  Beining Chen; Robert F Harrison; George Papadatos; Peter Willett; David J Wood; Xiao Qing Lewell; Paulette Greenidge; Nikolaus Stiefl
Journal:  J Comput Aided Mol Des       Date:  2007-01-05       Impact factor: 3.686

5.  Similarity searching in files of three-dimensional chemical structures: representation and searching of molecular electrostatic potentials using field-graphs.

Authors:  D A Thorner; P Willett; P M Wright; R Taylor
Journal:  J Comput Aided Mol Des       Date:  1997-03       Impact factor: 3.686

6.  Prediction of Orthosteric and Allosteric Regulations on Cannabinoid Receptors Using Supervised Machine Learning Classifiers.

Authors:  Yuemin Bian; Yankang Jing; Lirong Wang; Shifan Ma; Jaden Jungho Jun; Xiang-Qun Xie
Journal:  Mol Pharm       Date:  2019-05-03       Impact factor: 4.939

7.  The inevitable QSAR renaissance.

Authors:  Richard D Cramer
Journal:  J Comput Aided Mol Des       Date:  2011-11-30       Impact factor: 3.686

Review 8.  Computer-assisted studies of molecular structure and genotoxic activity by pattern recognition techniques.

Authors:  T R Stouch; P C Jurs
Journal:  Environ Health Perspect       Date:  1985-09       Impact factor: 9.031

9.  Relationship between molecular connectivity and carcinogenic activity: a confirmation with a new software program based on graph theory.

Authors:  D Malacarne; R Pesenti; M Paolucci; S Parodi
Journal:  Environ Health Perspect       Date:  1993-09       Impact factor: 9.031

Review 10.  Substructural QSAR approaches and topological pharmacophores.

Authors:  R Franke; S Huebel; W J Streich
Journal:  Environ Health Perspect       Date:  1985-09       Impact factor: 9.031
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