Efficient Generation, Storage, and Manipulation of Fully Flexible Pharmacophore Multiplets and Their Use in 3-D Similarity Searching-Reference-Cited by-同舟云学术

Efficient Generation, Storage, and Manipulation of Fully Flexible Pharmacophore Multiplets and Their Use in 3-D Similarity Searching

Published:2003-01-28 Issue:2 Volume:43 Page:458-468
ISSN:0095-2338
Container-title:Journal of Chemical Information and Computer Sciences
language:en
Short-container-title:J. Chem. Inf. Comput. Sci.

Author:

Abrahamian Edmond¹,Fox Peter C.¹,Nærum Lars¹,Christensen Inge Thøger¹,Thøgersen Henning¹,Clark Robert D.¹

Affiliation:

1. Tripos, Inc., 1699 South Hanley Road, St. Louis, Missouri 63144, and Novo Nordisk A/S, Medicinal Chemistry Research, Novo Nordisk Park, 2760 Måløv, Denmark

Publisher

American Chemical Society (ACS)

Subject

Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci025595r

Reference32 articles.

1. Use of Structure−Activity Data To Compare Structure-Based Clustering Methods and Descriptors for Use in Compound Selection

2. Designing Chemical Libraries for Lead Discovery

3. New 4-Point Pharmacophore Method for Molecular Similarity and Diversity Applications: Overview of the Method and Applications, Including a Novel Approach to the Design of Combinatorial Libraries Containing Privileged Substructures

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