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DRUG CRYSTAL STRUCTURE LANDSCAPE ANALYSIS SYSTEM AND LANDSCAPE ANALYSIS METHOD THEREOF
DRUG CRYSTAL STRUCTURE LANDSCAPE ANALYSIS SYSTEM AND LANDSCAPE ANALYSIS METHOD THEREOF
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机译:药物结构景观分析系统及其景观分析方法
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摘要
The invention belongs to the technical field of drug crystal analysis, and particularly relates to a drug crystal structure landscape analysis system and a landscape analysis method thereof. The drug crystal structure landscape analysis system calls a cloud computing interface to calculate the energy of input crystals through an algorithm deployed in the cloud in advance, and an energy-density space group landscape array diagram of the crystals is generated according to the computation results returned; and analysis is selectively carried out as needed, result reports arc analyzed and summarized as a final report, and the final report is converted into a text document. The drug crystal structure landscape analysis system and the landscape analysis method thereof satisfy the drug crystal structure analysis requirements in the new technology background, and can analyze a large quantity of crystals which are formed by a certain drug molecule and have different structures.
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