MOLEonline 2.0: interactive web-based analysis of biomacromolecular channels. Berka, K., Hanák, O., Sehnal, D., Banáš, P., Navrátilová, V., Jaiswal, D., Ionescu, C., Vařeková, R. S., Koča, J., & Otyepka, M. Nucleic Acids Research, 40(W1):W222–W227, July, 2012.
Paper doi abstract bibtex Biomolecular channels play important roles in many biological systems, e.g. enzymes, ribosomes and ion channels. This article introduces a web-based interactive MOLEonline 2.0 application for the analysis of access/egress paths to interior molecular voids. MOLEonline 2.0 enables platform-independent, easy-to-use and interactive analyses of (bio)macromolecular channels, tunnels and pores. Results are presented in a clear manner, making their interpretation easy. For each channel, MOLEonline displays a 3D graphical representation of the channel, its profile accompanied by a list of lining residues and also its basic physicochemical properties. The users can tune advanced parameters when performing a channel search to direct the search according to their needs. The MOLEonline 2.0 application is freely available via the Internet at http://ncbr.muni.cz/mole or http://mole.upol.cz.
@article{berka_moleonline_2012,
title = {{MOLEonline} 2.0: interactive web-based analysis of biomacromolecular channels},
volume = {40},
issn = {0305-1048, 1362-4962},
shorttitle = {{MOLEonline} 2.0},
url = {http://nar.oxfordjournals.org.gate1.inist.fr/content/40/W1/W222},
doi = {10.1093/nar/gks363},
abstract = {Biomolecular channels play important roles in many biological systems, e.g. enzymes, ribosomes and ion channels. This article introduces a web-based interactive MOLEonline 2.0 application for the analysis of access/egress paths to interior molecular voids. MOLEonline 2.0 enables platform-independent, easy-to-use and interactive analyses of (bio)macromolecular channels, tunnels and pores. Results are presented in a clear manner, making their interpretation easy. For each channel, MOLEonline displays a 3D graphical representation of the channel, its profile accompanied by a list of lining residues and also its basic physicochemical properties. The users can tune advanced parameters when performing a channel search to direct the search according to their needs. The MOLEonline 2.0 application is freely available via the Internet at http://ncbr.muni.cz/mole or http://mole.upol.cz.},
language = {en},
number = {W1},
urldate = {2015-11-30},
journal = {Nucleic Acids Research},
author = {Berka, Karel and Hanák, Ondřej and Sehnal, David and Banáš, Pavel and Navrátilová, Veronika and Jaiswal, Deepti and Ionescu, Crina-Maria and Vařeková, Radka Svobodová and Koča, Jaroslav and Otyepka, Michal},
month = jul,
year = {2012},
pmid = {22553366},
pages = {W222--W227},
}
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