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platensimycin
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/platensimycin.html6 May 2024: c1-22(7-6-17(28)25-18-14(26)4-3-13(19(18)29)21(30)31)16(27)5-8-24-10-12-9-15(20(22)24) ... 32-23(12,2)11-24/h3-5,8,12,15,20,26,29H,6-7,9-11H2,1-2H3,(H,25,28)(H,30,31)/t12-,15+,20+,22-,23+, -
power of prime input and output
https://www-jmg.ch.cam.ac.uk/cil/SGTL/pp.html6 May 2024: would be read as 24 sqrt(15/14). Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v9n2.html21 Apr 2013: Chemical Informatics Letters. Volume 9, Issue 2; August 2004. Editor: Jonathan M Goodman. 13). The popularity of RSS feeds appears to be increasing. There is an index of academic library RSS feeds at Iowa State, RSS access to Topix.net's section for -
glabrescol
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/glabrescol.html6 May 2024: 22(33-21)28(6)18-14-24(37-28)30(8)16-12-20(35-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19-,20-, ... 21-,22-,23-,24-,27+,28+,29+,30+/m1/s1. -
laulimalide
https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/laulimalide.html6 May 2024: 3)14-20(2)16-24-8-4-6-22(35-24)7-5-9-29(33)36-27/h4-6,9-12,20,22-28,30-32H,3,7-8, ... 13-18H2,1-2H3/b9-5-,11-10+/t20-,22-,23+,24-,25-,26-,27+,28-,30-/m0/s1. -
macroModel atom types
https://www-jmg.ch.cam.ac.uk/cil/SGTL/mmod_atomtypes.html6 May 2024: Oxygen 24 N1 Nitrogen - SP 10 25 N2 N - SP2 9 N,NR,NP, N,NB,NC NH1,NH2 N,N2 26 N3 N - SP3 8 NH3 NT 27 NA United ... C,S) 5 HA HC,HS 42 H2 H-O(Neut) 21,24 H,HC HO 43 H3 H-N(Neut) 23 H,HC H,H2 44 H4 H-Cation H3 -
RBx11160
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/antimalarial.html6 May 2024: O)CC1CCC2(CC1)OOC3(O2)C4CC5CC(C4)CC3C5. InChI. ... 27-21)17-8-15-7-16(10-17)11-18(22)9-15/h14-18H,3-13,23H2,1-2H3,(H,24,25)/t14-,15?,16?,17?,18?,21+,22-. -
c60
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/c60.html6 May 2024: 13(5)23-24-14(6)22-18(8)28-20(12)30-26-16(10)15(9)25-29-19(11)27(17)37-41-31(21)33(23)43- ... 44-34(24)32(22)42-38(28)48-40(30)46-36(26)35(25)45-39(29)47(37)55-49(41)51(43)57-52(44)50(42) -
c70
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/c70.html6 May 2024: 16%20)C%21=C%22C%23=C(C%24=C%21C%19=C%25C%26=C%24C%27=C6C%11=C%26C%28=C%10C%12=C%15C%20=C% ... c%31c%32%35)c%36c%12c%13c%28c%29c%30%36)c%26%27. InChI. -
erythromycin
https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/erythromycin.html6 May 2024: C)O. InChI. ... 28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19?,20+,21+,22-,23?,24?,25-,26?,28?,29+,30-,31?,32-,34?,35-,36?,37-/m1/s1. -
dracorubin
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/dracorubin.html6 May 2024: 20-11-7-4-8-12-20)30-28(37-31(18)29)17-26(34-2)21-13-14-24(36-32(21)30)19-9-5-3-6-10- ... 18,10,17,13,20,34,36,12,24,19/E:(5,6)(7,8)(9,10)(11,12)/it:im/rA:37nCCCCCCCCCCCOCCCCCCOCCCCOCCCCCCCCCOCOC/rB:d1;s2;d3;s4;s1d5;s4;d7; -
9,10 dimethoxy[7]helicene
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/helicene.html6 May 2024: 2)18-16-22-14-12-20-8-4-6-10-24(20)28(22)30/h3-18H,1-2H3. ... AuxInfo=1/0/N:21,22,34,28,32,30,33,27,31,29,13,7,14,8,24,26,23,25,18,12,15,9,17,11,6,3,16, -
cavicularin
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cavicularin.html6 May 2024: SMILES. InChI. ... 18,24,28,19,11,29,16,3,6,26,9,4,15,17,23,8,5,1,12,2,7,13,31,22,30,14/E:(1,2)(7,8)/ -
dolabriferol
https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/dolabriferol.html6 May 2024: 1/C21H38O6/c1-9-16(22)12(5)17(23)13(6)20(24)26-19-14(7)18(11(3)4)27-21(25,10-2)15(19)8/h11- ... AuxInfo=1/0/N:17,25,8,9,26,27,20,18,16,24,7,14,12,2,6,15,13,3,1,11,5,22,21,23,19,10,4/ -
taxol
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/taxol.html6 May 2024: 24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22- ... 36,58,40,2,19,17,6,35,34,7,9,11,8,56,39,33,5,10,16,4,54,28,47,24,53,15,57,41,37,25,21, -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v13n2.html24 Aug 2007: Chemical Informatics Letters. Volume 13, Issue 2; August 2006. Editor: Jonathan M Goodman. 13). Intute is a free online service providing you with access to the very best Web resources for education and research, replacing PSIgate and related -
amphidinoketide I
https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/amphidinoketideI.html6 May 2024: 24(28)19(5)15-22(26)12-11-21(25)13-17(2)3/h7,13,18-20H,1,8-12,14-16H2,2-6H3/t18-,19+,20+/m0/s1. ... 24/E:(2,3)/it:im/rA:28nCCCCCCCCCCCCCCCCCCCCCOCOCOOC/rB:d1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;s15;s16;s17;d18;s19;N6;d8;P9; -
https://www-jmg.ch.cam.ac.uk/CIL/rss/cil.xml
https://www-jmg.ch.cam.ac.uk/CIL/rss/cil.xml24 Aug 2007: 2000-2007 J M Goodman Fri Aug 24 22:45:34 BST 2007 Chemical Informatics Letters http://www-jmg.ch.cam.ac.uk/CIL/cil.gif ... ac.uk/CIL/ (24) PhysChem http://www-jmg.ch.cam.ac.uk/CIL/cil_v15n2.html#24 PhysChem Forum is a forum for scientists doing -
DNA (ten base pairs)
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/dna10.html6 May 2024: O[P@](O)(O[C@@]([H])([H])[C@@]%24([H])O[C@@](N%25[C@](N([H])[C@]([C@@]([C@]([H])([H])[H])=[C@]%25[H])=O)=O)([H])[C@]([H])([ ... H])[C@@]%24([H])O[H])=O)=O)=O)=O)=O)=O)=O)=O)=O)(O)O.O=[P@](O[C@]([H])([H])[C@]%26([H])O[C@@](N%27[C@]( -
CIL Index
https://www-jmg.ch.cam.ac.uk/CIL/autoindexJ.html24 Aug 2007: Open J-Gate (Chem. Inf. Lett. 2006, 13, #2, 24). Japan. ... Open J-Gate (Chem. Inf. Lett. 2006, 13, #2, 24). Jie. -
Neon
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/neon.html7 Jun 2011: Melting point / K : 24.48. Boiling point / K : 27.10. -
APPENDIX 2 XED/COSMIC ATOM TYPES XED/Cosmic Atom Types - ...
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xa2_typ.html8 Nov 2010: 7. 23. N sp(CN). triple. 1. Nitrile only. 8. 24. O (PO &SO). -
Silver
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/silver.html7 Jun 2011: 7. Pacific deep : 24 10. -7. B I O L O G I C A L D A T A. -
Book 2. CHANGE- Move the cursor over the book ...
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk2.html8 Nov 2010: rotation). Colours run from 1 to 24. See Book 2 page 1 'Colours' for the colour code. -
Bromine
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/bromine.html7 Jun 2011: 7.7. Daily dietary intake : 0.8 - 24 mg. Total mass of element. -
Calcium
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/calcium.html7 Jun 2011: Abundances. Sun (relative to H = 1 10. 12. ) : 2.24 10. -
publications
https://www-jmg.ch.cam.ac.uk/publications/6 May 2024: 24). The Case for Content Integrity in Electronic Chemistry Journals: The CLIC Project. -
Neodynium
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/neodynium.html7 Jun 2011: C = 12.0000) : 144.24. P H Y S I C A L D A T A. -
Chromium
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/chromium.html7 Jun 2011: Cr. Chromium. Atomic number : 24. Relative atomic mass (. 12. -
Magnesium
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/magnesium.html7 Jun 2011: C = 12.0000) : 24.3050. P H Y S I C A L D A T A. -
pluronic L31
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/l31.html6 May 2024: 34-50(10)70-32-48(8)68-30-46(6)66-28-44(4)64-26-42(2)62-24-23-60-20-18-58/h41-58H,17-40H2,1- ... 11,57,14,54,17,51,20,48,23,45,26,42,29,77,9,61,12,58,15,55,18,52,21,49,24,46,27,43,30,78,1, -
spongistatin 1
https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/spongistatin.html6 May 2024: 24-46(83-62)26-54(71)80-57/h13,15,17-18,36-39,42-49,51-53,55-59,67-68,70,72-75H,1-3,12,14,16, ... 4,46,50,52,24,13,26,53,68,86,78,61,81,11,70,33,44,72,74,71,79,82,3,49,47,20,12,32,27,54/it: -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol14.html3 Jul 2007: Chemical Informatics Letters. Editor:Volume 14. (1). Computational Crystallography Toolbox. The Computational Crystallography Toolbox is an open source component of the PHENIX (Python-based Hierarchical ENvironment for Integrated Xtallography) -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v14n2.html24 Aug 2007: Chemical Informatics Letters. Volume 14, Issue 2; February 2007. Editor: Jonathan M Goodman. 13). The end of open review in Nature. The editors of Nature have ended their experiment in open review, which allowed authors who passed an initial -
Trp-cage
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/pdb1l2y.html6 May 2024: 20-12-32-105-98(103)104)94(150)124-35-15-23-72(124)96(152)125-36-16-24-73(125)95(151)123-34-14-22-71(123) ... 92(148)120-69(49-128)97(153)154/h8-9,17-18,25-28,43,50-52,57,59-73,80,106,126-129H,7,10-16,19-24,29- -
CIL Index
https://www-jmg.ch.cam.ac.uk/CIL/autoindexU.html24 Aug 2007: Masters course in Chemical Informatics (Chem. Inf. Lett. 2005, 11, #2, 24). -
The Periodic Table
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/table.html7 Jun 2011: You may view additional information on a particular element. Simply click on the element's name or formula in the table below. Pictures representing each element are avaiable on ChemSoc's Visual Elements site. 2. 13. 14. 15. 16. 17. 2. 3. 4. 5. 6. -
The Elements Sorted by Name
https://www-jmg.ch.cam.ac.uk/resources/misc/weii/elements.html7 Jun 2011: 98. 19. 6. 59. 58. 61. 17. 91. 24. 88. 27. -
https://www-jmg.ch.cam.ac.uk/data/solubility/s032.txt
https://www-jmg.ch.cam.ac.uk/data/solubility/s032.txt15 Apr 2008: 8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20, ... 25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2. -
InChIKey Collision
https://www-jmg.ch.cam.ac.uk/data/inchi/6 May 2024: 69)38(6)56(78-41(9)66)36(4)34(2)21-49-28-60(10,74)32-62(84-49)30-48(77-40(8)65)24-46(83- -
arginine
https://www-jmg.ch.cam.ac.uk/data/molecules/amino/arg.html6 May 2024: d7;s7;s2;d10;s10;/rC:-1.4289,-1.6525,0;-.7145,-1.24,0;-.7145,-.415,0;0,-.0025,0;0,.8225,0;.7145,1.235,0;.7145,2.06, ... 0;1.4289,2.4725,0;0,2.4725,0;-.0029,-2.0617,0;-.0029,-1.24,0;-.7145,-2.4725,0;. Structure files. MInChI v0.9. MInChIxe1 C6H14N4O2 -
supinfS22
https://www-jmg.ch.cam.ac.uk/data/forcefield/supinfS22.pdf8 Jan 2009: shaped) 27.95 10.09 13.33 24.72 0.0873Phenol dimer 3.82 3.82 -25.78 33.42 0.3780. ... 10.09 13.50 24.54 0.0880Phenol dimer 3.82 3.82 -25.57 33.22 0.3990. -
100 data
https://www-jmg.ch.cam.ac.uk/data/solubility/soldataswap.xls5 Aug 2008: 26-27H,(H,19,22)(H,24,25)/b21-20+. sulfathiazole. 25.59. ... b17-9-/t25-/m1/s1. sulindac_form_II. 24.83. 19. 0.15972. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v12n2.html24 Aug 2007: Some free programs and databases are listed here:. 24). -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol12.html27 Jul 2006: Some free programs and databases are listed here:. 24). -
abietic acid
https://www-jmg.ch.cam.ac.uk/data/molecules/misc/abietic_acid.html6 May 2024: 2,11,15,12,9,10,4,22,5,3,23,24/E:(1,2)(21,22)/it:im/rA:24nCCCCCCCCCCCCCCCCCHHCCCOO/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;s5s9; -
PDFJSCHSupInf
https://www-jmg.ch.cam.ac.uk/data/forcefield/supinfJSCH2005.pdf8 Jan 2009: 66 2.9630Guanine : 4-Thiouracil opt -132.20 -253.85 -430.29 44.24 0.2840Guanine : 2-Thiouracil opt -132.20 -216.84 -375.31 26.27 0.6730Adenine : Cytosine (planar) ... PDB:1BRF) const 248.59 78.24 50.81 276.02 0.1700. -
CIL Index
https://www-jmg.ch.cam.ac.uk/CIL/autoindexR.html24 Aug 2007: ChemIndex (Chem. Inf. Lett. 2003, 7, #2, 24). -
DOCK 2 MOLECULES: This docker brings one movable (but ...
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_dk.html8 Nov 2010: The sequential docking takes many hours. For 40 waters to solvate a small t-butyl ammonium cation, the batch job ran for about 24 hours on a 4000 (100MHz) SGI! -
https://www-jmg.ch.cam.ac.uk/data/solubility/s032probenecid.txt
https://www-jmg.ch.cam.ac.uk/data/solubility/s032probenecid.txt5 Aug 2008: 8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20, ... 25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2.
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