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On the Interpretation of High Throughput MS Based Metabolomics Fingerprints with Random Forest 基于MS的高通量代谢组学指纹图谱的随机森林分析
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_22
D. Enot, M. Beckmann, J. Draper
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引用次数: 6
A Point-Matching Based Algorithm for 3D Surface Alignment of Drug-Sized Molecules 基于点匹配的药物大小分子三维表面排列算法
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_18
D. Baum, H. Hege
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引用次数: 8
A Simple Method to Simultaneously Track the Numbers of Expressed Channel Proteins in a Neuron 一种同时跟踪神经元中表达通道蛋白数量的简单方法
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_25
A. Faisal, J. Niven
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引用次数: 4
The Language of Cortical Dynamics 皮层动力学的语言
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_24
Péter András
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引用次数: 0
Adaptive Approach for Modelling Variability in Pharmacokinetics 药代动力学变异性建模的自适应方法
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_19
A. Weiße, I. Horenko, W. Huisinga
{"title":"Adaptive Approach for Modelling Variability in Pharmacokinetics","authors":"A. Weiße, I. Horenko, W. Huisinga","doi":"10.1007/11875741_19","DOIUrl":"https://doi.org/10.1007/11875741_19","url":null,"abstract":"","PeriodicalId":396901,"journal":{"name":"International Symposium on Computational Life Sciences","volume":"12 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2006-09-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"115439513","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 7
Grid Assisted Ensemble Molecular Dynamics Simulations of HIV-1 Proteases Reveal Novel Conformations of the Inhibitor Saquinavir 网格辅助的HIV-1蛋白酶整体分子动力学模拟揭示了抑制剂沙奎那韦的新构象
International Symposium on Computational Life Sciences Pub Date : 2006-09-27 DOI: 10.1007/11875741_15
S. Sadiq, S. Zasada, P. Coveney
{"title":"Grid Assisted Ensemble Molecular Dynamics Simulations of HIV-1 Proteases Reveal Novel Conformations of the Inhibitor Saquinavir","authors":"S. Sadiq, S. Zasada, P. Coveney","doi":"10.1007/11875741_15","DOIUrl":"https://doi.org/10.1007/11875741_15","url":null,"abstract":"","PeriodicalId":396901,"journal":{"name":"International Symposium on Computational Life Sciences","volume":"1 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2006-09-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"125825353","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 4
Efficiency Considerations in Solving Smoluchowski Equations for Rough Potentials 求解粗势Smoluchowski方程的效率考虑
International Symposium on Computational Life Sciences Pub Date : 2005-09-25 DOI: 10.1007/11560500_19
P. Banushkina, O. Schenk, M. Meuwly
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引用次数: 1
Molecular Similarity Searching Using COSMO Screening Charges (COSMO/3PP) 基于COSMO筛选电荷(COSMO/3PP)的分子相似性搜索
International Symposium on Computational Life Sciences Pub Date : 2005-09-25 DOI: 10.1007/11560500_16
A. Bender, A. Klamt, K. Wichmann, M. Thormann, R. Glen
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引用次数: 2
Increasing Diversity in In-silico Screening with Target Flexibility 增加目标灵活性在硅筛选中的多样性
International Symposium on Computational Life Sciences Pub Date : 2005-09-25 DOI: 10.1007/11560500_17
B. Fischer, H. Merlitz, W. Wenzel
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引用次数: 16
Visual Analysis of Molecular Conformations by Means of a Dynamic Density Mixture Model 基于动态密度混合模型的分子构象可视化分析
International Symposium on Computational Life Sciences Pub Date : 2005-09-25 DOI: 10.1007/11560500_21
Johannes Schmidt-Ehrenberg, H. Hege
{"title":"Visual Analysis of Molecular Conformations by Means of a Dynamic Density Mixture Model","authors":"Johannes Schmidt-Ehrenberg, H. Hege","doi":"10.1007/11560500_21","DOIUrl":"https://doi.org/10.1007/11560500_21","url":null,"abstract":"","PeriodicalId":396901,"journal":{"name":"International Symposium on Computational Life Sciences","volume":"310 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2005-09-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"122773281","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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