Please use this identifier to cite or link to this item: http://dspace.mediu.edu.my:8181/xmlui/handle/123456789/8456
Full metadata record
DC FieldValueLanguage
dc.creatorGuimarães Cristiano Ruch Werneck-
dc.creatorBarreiro Gabriela-
dc.creatorOliveira César Augusto Fernandes de-
dc.creatorAlencastro Ricardo Bicca de-
dc.date2004-
dc.date.accessioned2013-06-01T11:13:14Z-
dc.date.available2013-06-01T11:13:14Z-
dc.date.issued2013-06-01-
dc.identifierhttp://www.scielo.br/scielo.php?script=sci_arttext&pid=S0103-97332004000100016-
dc.identifierhttp://www.doaj.org/doaj?func=openurl&genre=article&issn=01039733&date=2004&volume=34&issue=1&spage=126-
dc.identifier.urihttp://koha.mediu.edu.my:8181/jspui/handle/123456789/8456-
dc.descriptionComputer simulations of biomolecular systems have achieved a significant importance in science as they provide information regarding structure, dynamics, and energetics of biomolecules that are inaccessible to experimental measuring techniques. In this work, some important aspects of the simulation of biomolecular systems are described. An overview of the most popular protein force fields, simple explicit water models for the simulation of liquid water, and different approaches to treat the boundaries of the system is presented. Also, studies conducted in our group illustrating successful simulations of three biomolecules (thrombin, L-type calcium channel and human Cytomegalovirus protease) through the application of simple explicit water models combined with protein force fields are discussed.-
dc.publisherSociedade Brasileira de Física-
dc.sourceBrazilian Journal of Physics-
dc.titleOn the application of simple explicit water models to the simulations of biomolecules-
Appears in Collections:Physics and Astronomy

Files in This Item:
There are no files associated with this item.


Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.