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SOFTWARE DEVELOPMENT TO CONVERT TOPOLOGY FILES FROM AMBER TO GROMACS FORMAT

SOFTWARE DEVELOPMENT TO CONVERT TOPOLOGY FILES FROM AMBER TO GROMACS FORMAT
将拓扑文件从 AMBER 格式转换为 GROMACS 格式的软件开发
批准号：
8361807
负责人：
ROBERT J WOODS
金额：
$0.18万
依托单位：
UNIVERSITY OF GEORGIA
依托单位国家：
美国
项目类别：
财政年份：
2011
资助国家：
美国
项目状态：
已结题
起止时间：
2011-02-01 至 2012-01-31
来源：
https://reporter.nih.gov/project-details/8361807
关键词：
AmberFundingGrantNational Center for Research ResourcesPrincipal InvestigatorResearchResearch InfrastructureResourcesRunningSourceUnited States National Institutes of Healthcomputerized toolscostfile formatsimulationsoftware development

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中文摘要
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英文摘要
This subproject is one of many research subprojects utilizing the resources provided by a Center grant funded by NIH/NCRR. Primary support for the subproject and the subproject's principal investigator may have been provided by other sources, including other NIH sources. The Total Cost listed for the subproject likely represents the estimated amount of Center infrastructure utilized by the subproject, not direct funding provided by the NCRR grant to the subproject or subproject staff. To aid in the dissemination of the GLYCAM force field, a computational tool is being developed that will automatically convert file formats so that either the AMBER or GROMACS simulational packages may be employed to run MD simulations with the GLYCAM force field.
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