A hybrid approach for addressing ring flexibility in 3D database searching
- 1 January 1997
- journal article
- research article
- Published by Springer Nature in Journal of Computer-Aided Molecular Design
- Vol. 11 (1) , 53-60
- https://doi.org/10.1023/a:1008023427310
Abstract
A hybrid approach for flexible 3D database searching is presented that addresses the problemof ring flexibility. It combines the explicit storage of up to 25 multiple conformations ofrings, with up...Keywords
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