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(2002) New software for searching the Cambridge Structural Database and visualizing crystal
structures. Acta Crystallogr Sect B Struct Sci 58:389–397
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Acta Crystallogr Sect B Struct Sci 57:815–827
112. CCDC (1994) Vista – a program for the analysis and display of data retrieved from the CSD
113. Sykes RA, McCabe P, Allen FH, Battle GM, Bruno IJ, Wood PA (2011) New software for
statistical analysis of Cambridge Structural Database data. J Appl Crystallogr 44:882–886
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Streek J, IUCr (2006) Mercury: visualization and analysis of crystal structures. J Appl
Crystallogr 39:453–457
115. Allen FH, Davies JE, Galloy JJ, Johnson O, Kennard O, Macrae CF, Mitchell EM, Mitchell
GF, Smith JM, Watson DG (1991) The development of versions 3 and 4 of the Cambridge
Structural Database system. J Chem Inf Comput Sci 31:187–204
116. Stumpfe D, Bajorath J (2011) Similarity searching. Wiley Interdiscip Rev Comput Mol Sci
1:260–282
117. Cambridge Crystallographic Data Centre CellCheckCSD – The Cambridge Crystallographic
Data Centre (CCDC)
118. White FJ, Gál Z, Griffin A, Skarzynski T, Meyer M, Prochniak G, Wood PA, Thomas IR
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searches of the Cambridge Structural Database. J Appl Crystallogr 37:331–334
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visualization and investigation of crystal structures. J Appl Crystallogr 41:466–470
121. Gelbrich T, Hursthouse MB (2005) A versatile procedure for the identification, description and
quantification of structural similarity in molecular crystals. CrystEngComm 7:324
122. Chisholm JA, Motherwell S (2005) COMPACK : a program for identifying crystal structure
similarity using distances. J Appl Crystallogr 38:228–231
123. Rohlíček J, Skořepová E, Babor M, Čejka J, IUCr (2016) CrystalCMP: an easy-to-use tool for
fast comparison of molecular packing. J Appl Crystallogr 49:2172–2183
124. Salbego PRSS, Bender CR, Hörner M, Zanatta N, Frizzo CP, Bonacorso HG, Martins MAPP
(2018) Insights on the similarity of supramolecular structures in organic crystals using
quantitative indexes. ACS Omega 3:2569–2578
125. Thomas IR, Bruno IJ, Cole JC, Macrae CF, Pidcock E, Wood PA (2010) WebCSD : the online
portal to the Cambridge Structural Database. J Appl Crystallogr 43:362–366
126. FIZ Karlsruhe. https://icsd.products.fiz-karlsruhe.de/
127. RCSB PDB. https://www.rcsb.org/
128. Crystallography Open Database. http://www.crystallography.net/cod/index.php
129. CrystalWorks. https://cds.dl.ac.uk/cds/datasets/crys/cweb/cworks.html
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133. BCA (2020) Learn Crystallography. https://learn.crystallography.org.uk/
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135. CCDC
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https://www.ccdc.cam.ac.uk/Community/
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136. EBI (2020) Teaching materials. https://www.ebi.ac.uk/pdbe/training/teaching-materials
137. PDB (2020) PDB-101. https://pdb101.rcsb.org/
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