SYBYL line notation (SLN): A versatile language for chemical structure representation
被引:122
作者:
Ash, S
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机构:TRIPOS, Inc., St. Louis, MO 63144
Ash, S
Cline, MA
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机构:TRIPOS, Inc., St. Louis, MO 63144
Cline, MA
Homer, RW
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机构:TRIPOS, Inc., St. Louis, MO 63144
Homer, RW
Hurst, T
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机构:TRIPOS, Inc., St. Louis, MO 63144
Hurst, T
Smith, GB
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机构:TRIPOS, Inc., St. Louis, MO 63144
Smith, GB
机构:
[1] TRIPOS, Inc., St. Louis, MO 63144
来源:
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES
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1997年
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37卷
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01期
关键词:
D O I:
10.1021/ci960109j
中图分类号:
O6 [化学];
学科分类号:
0703 ;
摘要:
SYBYL Line Notation (SLN) is an ASCII language used to represent chemical structures, including common organic molecules, macromolecules, polymers, and combinatorial libraries. SLN is also used to express substructural (2D) queries and includes a complete facility for Markush representation. This concise language is ideal for database storage of chemical entities as well as for network communication of structures and queries.