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NAMD-LITE

NAMD-LITE
NAMD-LITE
批准号:
7601237
负责人:
DAVID J HARDY
金额:
$6.19万
依托单位国家:
美国
项目类别:
财政年份:
2007
资助国家:
美国
项目状态:
已结题
起止时间:
2007-08-15 至 2008-07-31

项目摘要

项目成果

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中文摘要
翻译
这个子项目是许多利用 由NIH/NCRR资助的中心赠款提供的资源。子项目和 研究者(PI)可能从另一个NIH来源获得了主要资金, 因此可在其他CRISP条目中表示。所列机构为 研究中心,而研究中心不一定是研究者所在的机构。 NAMD-Lite(http://www.ks.uiuc.edu/Development/MDTools/namdlite/)是一个快速原型框架,用于开发生物分子的新模拟方法,由具有模块化设计的顺序C语言代码组成。其目的是将方法的开发与并行实施带来的额外复杂性分开,提供一种更简单的方法,在将新方法引入NAMD之前对其进行测试和验证(http://www.ks.uiuc.edu/Research/namd/)。源代码在伊利诺伊大学/NCSA开源许可证(http://www.opensource.org/licenses/UoI-NCSA.php)下分发,允许科学家完全自由地修改所有代码。
英文摘要
This subproject is one of many research subprojects utilizing the resources provided by a Center grant funded by NIH/NCRR. The subproject and investigator (PI) may have received primary funding from another NIH source, and thus could be represented in other CRISP entries. The institution listed is for the Center, which is not necessarily the institution for the investigator. NAMD-Lite (http://www.ks.uiuc.edu/Development/MDTools/namdlite/) is a rapid prototyping framework for developing new simulation methods for biomolecules, consisting of sequential C language code with a modular design. The intention is to separate the development of methods from the additional complication due to parallel implementation, providing a simpler way to test and validate new methods before bringing them into NAMD (http://www.ks.uiuc.edu/Research/namd/). The source code is distributed under the University of Illinois/NCSA Open Source License (http://www.opensource.org/licenses/UoI-NCSA.php) to allow scientists complete freedom over all of their code modifications.
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会议论文
NAMD-LITE AND MOLECULAR SIMULATION METHODS DEVELOPMENT
NAMD-LITE AND MOLECULAR SIMULATION METHODS DEVELOPMENT
ACCELERATION OF MOLECULAR MODELING APPLICATIONS WITH GRAPHICS PROCESSORS
ACCELERATION OF MOLECULAR MODELING APPLICATIONS WITH GRAPHICS PROCESSORS
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