98 search results - page 1 / 20 » Application of evolutionary computing to conformational anal... |
IIS
2004
13 years 7 months ago
2004
In this paper we report new results concerning use of genetic algorithms in conformational analysis, field of pharmacy related to discovery and design of new drugs. The goal is to ...
CVPR
2009
IEEE
15 years 21 days ago
2009
IEEE
All surfaces can be classified by the conformal equivalence
relation. Conformal invariants, which are shape indices
that can be defined intrinsically on a surface, may
be used t...
VISUALIZATION
2002
IEEE
13 years 10 months ago
2002
IEEE
The bioactivity of a molecule strongly depends on its metastable conformational shapes and the transitions between these. Therefore, conformation analysis and visualization is a b...
JCC
2007
13 years 5 months ago
2007
Abstract: A novel self-organizing algorithm for conformational sampling is introduced, in which precomputed conformations of rigid fragments are used as templates to enforce the de...
BMCBI
2010
13 years 5 months ago
2010
Background: Modelling the ligand binding site of a protein is an important component of understanding proteinligand interactions and is being actively studied. Even if the side ch...