MODELING ENZYME STRUCTURE AND FUNCTION
酶结构和功能建模
基本信息
- 批准号:8171848
- 负责人:
- 金额:$ 0.14万
- 依托单位:
- 依托单位国家:美国
- 项目类别:
- 财政年份:2010
- 资助国家:美国
- 起止时间:2010-08-01 至 2013-07-31
- 项目状态:已结题
- 来源:
- 关键词:AccelerationBiochemical ReactionBiomedical ResearchCatalysisCommunitiesComputer Retrieval of Information on Scientific Projects DatabaseComputer SimulationComputing MethodologiesDevelopmentDiseaseEnzymesFundingFutureGrantHybridsInformation TheoryInstitutionMethodsModelingPotential EnergyPrevention strategyResearchResearch PersonnelResourcesScienceSourceStructure-Activity RelationshipUnited States National Institutes of Healthbaseenzyme structureimprovedinsightknowledge baseprotein structure predictionquantumstructural biologytheoriestool
项目摘要
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.
My current research and future research plans revolve around advancing computational methods and applying them to better understand two key subjects in computational structural biology; the source of rate accelerations in enzymatic reactions and the prediction of protein structure from its primary sequence. Advances in theory and computer simulations; particularly through the use of hybrid Quantum/Classical potential energy functions, are providing new insights into the many sources of enzyme catalysis (Science, 2003, 303:186-195). Advances in information theory, knowledge-based energy functions and refinement methods are providing the basis to construct advanced tools for protein structure prediction (Science, 2001, 294:93-96). Yet there is still a critical need in the biomedical research community to make these methods more accurate and more generally applicable. Improving these methods will have great relevance to structure-function relationships and the development of new strategies for the prevention and treatment of disease.
这个子项目是众多研究子项目之一
项目成果
期刊论文数量(0)
专著数量(0)
科研奖励数量(0)
会议论文数量(0)
专利数量(0)
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TROY WYMORE其他文献
TROY WYMORE的其他文献
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{{ truncateString('TROY WYMORE', 18)}}的其他基金
THE CLASS D BETA-LACTAMASE FAMILY: RESIDUES GOVERNING THE MAINTENANCE AND DIVER
D 类 β-内酰胺酶家族:控制维护和潜水员的残留物
- 批准号:
8364377 - 财政年份:2011
- 资助金额:
$ 0.14万 - 项目类别:
CORE 2006-2011: DEVELOPMENT OF HYBRID QUANTUM MECHANICAL/MOLECULAR MECHANICAL (
核心2006-2011:混合量子力学/分子力学的发展(
- 批准号:
8364274 - 财政年份:2011
- 资助金额:
$ 0.14万 - 项目类别:
METHODS AND APPLICATIONS OF HYBRID QC/MM SIMULATIONS TO BIOMOLECULAR SYSTEMS
生物分子系统混合 QC/MM 模拟的方法和应用
- 批准号:
8364395 - 财政年份:2011
- 资助金额:
$ 0.14万 - 项目类别:
EPISTASIS IN TERPENE SYNTHASE CATALYTIC LANDSCAPE
萜烯合成酶催化景观中的上位性
- 批准号:
8364294 - 财政年份:2011
- 资助金额:
$ 0.14万 - 项目类别:
EPISTASIS IN TERPENE SYNTHASE CATALYTIC LANDSCAPE
萜烯合成酶催化景观中的上位性
- 批准号:
8171909 - 财政年份:2010
- 资助金额:
$ 0.14万 - 项目类别:
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