WebCSD: the online portal to the Cambridge Structural Database

被引：118

作者：

Thomas, Ian R. ^{[1
]}

Bruno, Ian J. ^{[1
]}

Cole, Jason C. ^{[1
]}

Macrae, Clare F. ^{[1
]}

Pidcock, Elna ^{[1
]}

Wood, Peter A. ^{[1
]}

机构：

[1] Cambridge Crystallog Data Ctr, Cambridge, England

来源：

JOURNAL OF APPLIED CRYSTALLOGRAPHY | 2010年 / 43卷

关键词：

CRYSTAL;

D O I：

10.1107/S0021889810000452

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

WebCSD, a new web-based application developed by the Cambridge Crystallographic Data Centre, offers fast searching of the Cambridge Structural Database using only a standard internet browser. Search facilities include two-dimensional substructure, molecular similarity, text/numeric and reduced cell searching. Text, chemical diagrams and three-dimensional structural information can all be studied in the results browser using the efficient entry summaries and embedded three-dimensional viewer.

引用

收藏

页码：362 / 366

页数：5

相关论文

共 34 条

[1] SYNTHESIS OF 1,2,6-THIADIAZINE 1,1-DIOXIDES VIA ISOXAZOLYLSULFAMIDES [J].

ALBRECHT, HA ;

BLOUNT, JF ;

KONZELMANN, FM ;

PLATI, JT .

JOURNAL OF ORGANIC CHEMISTRY, 1979, 44 (23) :4191-4194

[2] CIF applications. XV. enCIFer: a program for viewing, editing and visualizing CIFs [J].

Allen, FH ;

Johnson, O ;

Shields, GP ;

Smith, BR ;

Towler, M .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2004, 37 :335-338

[3] The Cambridge Structural Database: a quarter of a million crystal structures and rising [J].

Allen, FH .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 2002, 58 (3 PART 1) :380-388

[4] THE DEVELOPMENT OF VERSION-3 AND VERSION-4 OF THE CAMBRIDGE STRUCTURAL DATABASE SYSTEM [J].

ALLEN, FH ;

DAVIES, JE ;

GALLOY, JJ ;

JOHNSON, O ;

KENNARD, O ;

MACRAE, CF ;

MITCHELL, EM ;

MITCHELL, GF ;

SMITH, JM ;

WATSON, DG .

JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 1991, 31 (02) :187-204

[5] LATTICES AND REDUCED CELLS AS POINTS IN 6-SPACE AND SELECTION OF BRAVAIS LATTICE TYPE BY PROJECTIONS [J].

ANDREWS, LC ;

BERNSTEIN, HJ .

ACTA CRYSTALLOGRAPHICA SECTION A, 1988, 44 :1009-1018

[6] PERTURBATION STABLE CELL COMPARISON TECHNIQUE [J].

ANDREWS, LC ;

BERNSTEIN, HJ ;

PELLETIER, GA .

ACTA CRYSTALLOGRAPHICA SECTION A, 1980, 36 (MAR) :248-252

[7]

[Anonymous], 1990, M 196 1988 LOS ANG C

[8]

BATTLE GM, 2010, J CHEM ED UNPUB

[9] Tautomeric polymorphism in omeprazole [J].

Bhatt, Prashant M. ;

Desiraju, Gautam R. .

CHEMICAL COMMUNICATIONS, 2007, (20) :2057-2059

[10]

BODNER GM, 1997, CHEM ED, V2

← 1 2 3 4 →