gWEGA: GPU-accelerated WEGA for molecular superposition and shape comparison

Xin Yan, Jiabo Li, Qiong Gu, Jun Xu. gWEGA: GPU-accelerated WEGA for molecular superposition and shape comparison. Journal of Computational Chemistry, 35(15):1122-1130, 2014. [doi]

Authors

Xin Yan

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Jiabo Li

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Qiong Gu

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Jun Xu

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