Geodesic
Application of fRMSDchiral for mathematical description of mutual position between stereoisomers
Mathematica Applicanda, Tome 43 (2015) no. 1, pp. 37-48.

Voir la notice de l'article provenant de la source Annales Societatis Mathematicae Polonae Series

The ability of biological systems to recognize and distinguish between compounds is crucial for living systems. A detailed study of this mechanism seems to be an important supplement for analysis of possible contact interactions between compounds and environment. This process could be characterized by variety of descriptors respond to compounds’ structural and physicochemical properties. Usually, the measure of variation in molecule positions in the three dimensional space is realized by the Root Mean Square Deviation (RMSD) calculation. Here, the traditional concept of RMSD was readjusted as fragment-level RMSD (fRMSD) and applied for mathematical description of stereoisomers’ role in the chiral recognition process.
DOI : 10.14708/ma.v43i1.709
Classification : 62J05, 92D20
Mots-clés : fragment-level RMSD, chiral recognition, bioinformatics, molecular modeling 
@article{10_14708_ma_v43i1_709,
     author = {Rafal Damian Urniaz},
     title = {Application of {fRMSDchiral} for mathematical description of mutual position between stereoisomers},
     journal = {Mathematica Applicanda},
     pages = { 37--48},
     publisher = {mathdoc},
     volume = {43},
     number = {1},
     year = {2015},
     doi = {10.14708/ma.v43i1.709},
     language = {pl},
     url = {http://geodesic.mathdoc.fr/articles/10.14708/ma.v43i1.709/}
}
TY  - JOUR
AU  - Rafal Damian Urniaz
TI  - Application of fRMSDchiral for mathematical description of mutual position between stereoisomers
JO  - Mathematica Applicanda
PY  - 2015
SP  -  37
EP  - 48
VL  - 43
IS  - 1
PB  - mathdoc
UR  - http://geodesic.mathdoc.fr/articles/10.14708/ma.v43i1.709/
DO  - 10.14708/ma.v43i1.709
LA  - pl
ID  - 10_14708_ma_v43i1_709
ER  - 
%0 Journal Article
%A Rafal Damian Urniaz
%T Application of fRMSDchiral for mathematical description of mutual position between stereoisomers
%J Mathematica Applicanda
%D 2015
%P  37-48
%V 43
%N 1
%I mathdoc
%U http://geodesic.mathdoc.fr/articles/10.14708/ma.v43i1.709/
%R 10.14708/ma.v43i1.709
%G pl
%F 10_14708_ma_v43i1_709
Rafal Damian Urniaz. Application of fRMSDchiral for mathematical description of mutual position between stereoisomers. Mathematica Applicanda, Tome 43 (2015) no. 1, pp.  37-48. doi : 10.14708/ma.v43i1.709. http://geodesic.mathdoc.fr/articles/10.14708/ma.v43i1.709/

Cité par Sources :