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计算机化学模拟—分子构象识别的新方法 被引量:10
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作者 王瑾玲 孙命缪 方明 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2000年第4期281-287,共7页
简介了几种利用计算机图形技术研究化合物分子构象的新方法。重点介绍了分子力学计算方法中的系统搜索、随机搜索方法和分子动力学计算方法中的模拟淬火、模拟退火等新技术 ,为药物分子设计中受体与配体分子构象的识别提供了合理可行的... 简介了几种利用计算机图形技术研究化合物分子构象的新方法。重点介绍了分子力学计算方法中的系统搜索、随机搜索方法和分子动力学计算方法中的模拟淬火、模拟退火等新技术 ,为药物分子设计中受体与配体分子构象的识别提供了合理可行的方法。 展开更多
关键词 计算机化学模型 分子构象识别 药物分子设计
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HARDWARE-BASED VOXELIZATION FOR TRUE 3-D DISPLAY 被引量:5
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作者 谭皓 杨忠 +1 位作者 李玉峰 沈春林 《Transactions of Nanjing University of Aeronautics and Astronautics》 EI 2006年第1期59-64,共6页
An efficient voxelization algorithm is presented for polygonal models by using the hardware support for the 2 D rasterization algorithm and the GPU programmable function to satisfy the volumetric display system. The v... An efficient voxelization algorithm is presented for polygonal models by using the hardware support for the 2 D rasterization algorithm and the GPU programmable function to satisfy the volumetric display system. The volume is sampled into slices by the rendering hardware and then slices are rasterated into a series of voxels. A composed buffer is used to record encoded voxels of the target volume to reduce the graphic memory requirement. In the algorithm, dynamic vertexes and index buffers are used to improve the voxelization efficiency. Experimental results show that the algorithm is efficient for a true 3-D display system. 展开更多
关键词 computer graphics VOXELIZATION volumetric display mesh model
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A motion retargeting algorithm based on model simplification
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作者 Chen Zhihua(陈志华) Ma Lizhuang +1 位作者 Wu Xiaomao Gao Yan 《High Technology Letters》 EI CAS 2005年第3期225-228,共4页
A new motion retargeting algorithm is presented, which adapts me motion capture data to a new character. To make the resulting motion realistic, the physically-based optimization method is adopted. However, the optimi... A new motion retargeting algorithm is presented, which adapts me motion capture data to a new character. To make the resulting motion realistic, the physically-based optimization method is adopted. However, the optimization process is difficult to converge to the optimal value because of high complexity of the physical human model. In order to address this problem, an appropriate simplified model automatically determined by a motion analysis technique is utilized, and then motion retargeting with this simplified model as an intermediate agent is implemented. The entire motion retargeting algorithm involves three steps of nonlinearly constrained optimization: forward retargeting, motion scaling and inverse retargeting. Experimental results show the validity of this algorithm. 展开更多
关键词 computer graphics computer animation motion capture motion retargeting
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Markov Chain Model for Smoking Cessation Treatment
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作者 Dmitry Khramtsov Galina Sakharova +1 位作者 Nikolay Antonov Victoria Donitova 《Journal of Mathematics and System Science》 2014年第11期695-699,共5页
Probabilistic models are commonly used in computational medicine for diagnostics. Smoking cessation is an important issue of modern medicine. According to statistics about third part of male in global population are s... Probabilistic models are commonly used in computational medicine for diagnostics. Smoking cessation is an important issue of modern medicine. According to statistics about third part of male in global population are smokers. It is important to develop new approaches for smoking cessation treatment including methods of early diagnosis and development of individual treatment programs for each patient according to his or her physical peculiarities. One of the promising methods is computerized approach for tobacco treatment including electronic survey and computer data analysis. In this work we propose a probabilistic model based on Markov chain for estimation of patient behavior in the process on medical survey. This analysis can help to find out patient's individual characteristics and develop effective personal treatment program. Based on probabilistic model software was developed with aim to enhance diagnosis and developing individual smoking cessation treatment programs for each patient. 展开更多
关键词 Computational medicine decision rule Markov chain PROBABILITY
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