Data processing: measuring – calibrating – or testing – Measurement system – Performance or efficiency evaluation
Reexamination Certificate
2007-05-01
2007-05-01
Tsai, Carol S. W. (Department: 2857)
Data processing: measuring, calibrating, or testing
Measurement system
Performance or efficiency evaluation
C702S019000, C702S027000, C702S030000, C702S031000, C700S268000, C700S293000
Reexamination Certificate
active
10926781
ABSTRACT:
Steric features inherent in the three dimensional disposition of atoms in molecules can be represented as multiplets using a defined set of steric descriptors. The resulting multiplets can be encoded in a compressed form of bitstring known as a bitmap. Such bitmaps can be generated in compressed form and used to compare individual conformers or ensembles of conformers of molecules to each other without decompression. Such comparisons are useful in molecular similarity analysis, in molecular diversity analysis, in database searching, and in conformational analysis.
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Abrahamian Edmond
Clark Robert D.
Fox Peter
Metwally Essam
Tripos, Inc.
Tsai Carol S. W.
Weinberger Laurence
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