发明名称 |
Searchable molecular database |
摘要 |
A computer system comprising a database ( 100 ) having a plurality of records, is provided. Each record comprises a filed point representation representing field extrema for a conformation of a chemical structure. The database may include records for multiple conformations of the same chemical structure. Each record can have a searchable index of the filed point representation. In one embodiment the index is bit string. An indexing mechanism for generating an index, a searching mechanism for searching the database and a graphical user interface to enable a user to interface with the database ( 100 ) are also provided.
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申请公布号 |
US2006116974(A1) |
申请公布日期 |
2006.06.01 |
申请号 |
US20050526334 |
申请日期 |
2005.03.02 |
申请人 |
ASHWORTH PHILIP A;CHEESRIGHT TIM;MACKEY MARK D;VINTER JEREMY G |
发明人 |
ASHWORTH PHILIP A.;CHEESRIGHT TIM;MACKEY MARK D.;VINTER JEREMY G. |
分类号 |
G06F17/30;G06F17/50;G06F19/00 |
主分类号 |
G06F17/30 |
代理机构 |
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代理人 |
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主权项 |
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地址 |
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