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  1. Results that match 1 of 2 words

  2. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v8n2.html
    21 Apr 2013: Chemical Informatics Letters. Volume 8, Issue 2; Feburary 2004. Editor: Jonathan M Goodman. 13). Peter Gregory, the Royal Society of Chemistry's director of publishing, comments on open archive initiatives in an editorial in the final issue of
  3. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol8.html
    27 Jul 2006: Chemical Informatics Letters. Editor:Volume 8. (1). Science Inventory (January 2004). A searchable catalog of more than 4,000 science activities of the US environmental protection agency (EPA). The site allows keyword searches and highlights nine
  4. Announcement of a Competition to Predict Aqueous Solubility

    https://www-jmg.ch.cam.ac.uk/data/solubility/pss.doc
    3 Apr 2008: 24 Probenecid. 25 Pyrimethamine. 26 Salicylic acid. 27 Sulfamerazine. 28 Sulfamethizole.
  5. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexO.html
    24 Aug 2007: Open J-Gate (Chem. Inf. Lett. 2006, 13, #2, 24). ... Organic Eprints (Chem. Inf. Lett. 2004, 9, #2, 24).
  6. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v7n2.html
    21 Apr 2013: Chemical Informatics Letters. Volume 7, Issue 2; August 2003. Editor: Jonathan M Goodman. 13). was mentioned in (Chem. Inf. Lett. 2002, 5, #3, 1). It now has a website, explaining that it is a freely available collection of data about small
  7. Alkane Global Minima

    https://www-jmg.ch.cam.ac.uk/stuff/alkanes/short.html
    6 Jan 2011: Formula. Energy. Structure. Formula. Energy. Structure. C. 11. H. 24. 28.11. ... 16. 17.24. C. 3. H. 8. 6.27. C. 8. H. 18.
  8. https://www-jmg.ch.cam.ac.uk/data/solubility/s100.txt

    https://www-jmg.ch.cam.ac.uk/data/solubility/s100.txt
    15 Apr 2008: 22/h6,8-9,20H,3-5,7H2,1-2H3,(H,24,25)/t9-/m0/s1 loperamide 24.88 10 Co-solvent technique used. ... 26(30)16-14-23/h3-16,34H,17-22H2,1-2H3 l-proline 24.95 No precipitation detected.
  9. Butane Energy

    https://www-jmg.ch.cam.ac.uk/stuff/alkanes/c4.html
    6 Jan 2011: C(sp3) 65 11 14 4.6000 1.1130 1.1144 0.003 O1 0 H-C(sp3) 65 ANGLES, BEND AND STRETCH BEND ENERGIES 24 Bend interactions present -------------------------------------- Atom Numbers
  10. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexW.html
    24 Aug 2007: Drug names (Chem. Inf. Lett. 2005, 10, #2, 24).
  11. MOPAC- RUN & LOOK: The inclusion of this module ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_mo.html
    8 Nov 2010: Orbitals are colour coded up to 24 colours before recycling.
  12. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v6n2.html
    21 Apr 2013: Monterotondo (Mouse biology). (24).
  13. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol9.html
    27 Jul 2006: Chemical Informatics Letters. Editor:Volume 9. (1). Chemical Informatics Letters now available via RSS, which can be viewed on a web browser here, using the RDN's viewer, or by loading. http://www-jmg.ch.cam.ac.uk/CIL/rss/cil.xml. into any RSS reader
  14. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexE.html
    24 Aug 2007: Organic Eprints (Chem. Inf. Lett. 2004, 9, #2, 24). ERCIM.
  15. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v15n2.html
    24 Aug 2007: Chemical Informatics Letters. Volume 15, Issue 2; August 2007. Editor: Jonathan M Goodman. 13). will start using 10-digit registry numbers from January 2008, to allow for the huge number of new molecules being added to the database. The new digit
  16. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol13.html
    5 Jan 2007: Chemical Informatics Letters. Editor:Volume 13. (1). Definition and exchange of crystallographic data. International Tables for Crystallography: Volume G: Definition and exchange of crystallographic data, edited by Sydney Hall and Brian McMahon, is
  17. 1 Intrinsic Aqueous Solubility Prediction Scoring Sheet Code Name ...

    https://www-jmg.ch.cam.ac.uk/data/solubility/pss.pdf
    3 Apr 2008: OH. O. 23 (1R, 2R)-(-)- Pseudoephedrine and enantiomer. NH. OH. 24 Probenecid.
  18. https://www-jmg.ch.cam.ac.uk/CIL/rss/all.xml

    https://www-jmg.ch.cam.ac.uk/CIL/rss/all.xml
    24 Aug 2007: 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 practical research and analytical work. ... 24) Xdrawchem http://www-jmg.ch.cam.ac.uk/CIL/cil_v14n2.html#24 XDrawChem is a
  19. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v11n2.html
    24 Aug 2007: Chemical Informatics Letters. Volume 11, Issue 2; August 2005. Editor: Jonathan M Goodman. 13). Green Chemistry Assistant. This website from St Olaf College which is aimed mainly at undergraduates and does some chemical calculations and analyses the
  20. https://www-jmg.ch.cam.ac.uk/CIL/rss/new.xml

    https://www-jmg.ch.cam.ac.uk/CIL/rss/new.xml
    24 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
  21. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexT.html
    24 Aug 2007: Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24).
  22. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol10.html
    27 Jul 2006: Chemical Informatics Letters. Editor:Volume 10. (1). How much does it cost to publish a paper and then have access to the results? This study looks at the library expenditure for universities in the USA, and divides it by the number of articles
  23. Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/cil_v10n2.html
    24 Aug 2007: Chemical Informatics Letters. Volume 10, Issue 2; February 2005. Editor: Jonathan M Goodman. 13). Syracuse Research Corporation. The Syracuse Research Corporation provides a variety of free services including a PBT Profiler for estimating Persistent,
  24. index of InChI

    https://www-jmg.ch.cam.ac.uk/data/molecules/inchiindex.html
    6 May 2024: university of cambridge. index of InChI. Goodman Group, 2005-2024; privacy; last updated May 6, 2024.
  25. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexX.html
    24 Aug 2007: Xdrawchem (Chem. Inf. Lett. 2007, 14, #2, 24). XML.
  26. Page 3: Boron-Mediated Aldol Reactions

    https://www-jmg.ch.cam.ac.uk/stuff/ECTOC3/p3.html
    26 Jul 2005: boat B. constrained. ethanal. formaldehyde. 7.41. 1.84. 9.12. 14.24. 8.21. collapse.
  27. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexG.html
    24 Aug 2007: Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24).
  28. https://www-jmg.ch.cam.ac.uk/stuff/lactam/transtbutyl_mm2_chcl3_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/transtbutyl_mm2_chcl3_mc.log
    26 Jul 2005: 39 CONF 1 E = 18.61 ( 4.281) replaces structure 24 Minimization converged; gradient = 0.446E-01. ... 24.67 ( 0.110) is unique and stored as structure 90 Minimization converged; gradient = 0.428E-01.
  29. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexB.html
    24 Aug 2007: Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24).
  30. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol11.html
    27 Jul 2006: Chemical Informatics Letters. Editor:Volume 11. (1). The Senate comment on PubChem. This builds on the earlier decision. The Senate report calls upon NIH to "work with the private sector chemical information providers, with the primary goal of
  31. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cisdimer_mm2_chcl3_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cisdimer_mm2_chcl3_mc.log
    26 Jul 2005: 24.98 ( 0.344) is unique and stored as structure 10 CONF 1 E = -8.47 ( 0.974) rejected by energy CONF 1 E = -8.35 ( 1.043) rejected by energy ... LT. 0.500E-01 CONF 1 E = -27.89 ( 0.045) is unique and stored as structure 11 CONF 1 E = -24.94 ( 0.107) is
  32. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexL.html
    24 Aug 2007: Editor: Jonathan M Goodman. The Open Lab (Chem. Inf. Lett. 2000, 1, #6). Electronic Lab Notebooks (Chem. Inf. Lett. 2001, 3, #1). Karypis lab (Chem. Inf. Lett. 2007, 14, #1, 4). RAMBIOS (Chem. Inf. Lett. 2003, 6, #4, 37). laboratory. Undergraduate
  33. APPENDIX 5 FILE FORMATS 17.108 25 25 Ethyl Sulphonamide ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xa5_fmt.html
    8 Nov 2010: 7 21 9 22 10 23 12 24 13 25. 6 5.174075 5.365369 1.431309 1 -0.1027. ... 16 8.635511 3.939991 -0.025040 12 0.3431. 8 9.054147 2.977788 0.946559 24 -0.2967.
  34. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexD.html
    24 Aug 2007: Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24). ... Drug names (Chem. Inf. Lett. 2005, 10, #2, 24).
  35. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol15.html
    24 Aug 2007: Chemical Informatics Letters. Editor:Volume 15. (1). Optical Structure Recognition Application (OSRA). OSRA is a free program which converts pictures of molecules (in most common formats, including PDF, GIF, JPEG, PNG, TIFF) into SMILES. It can be
  36. https://www-jmg.ch.cam.ac.uk/stuff/lactam/translactam_amber_vacuo_mc.l…

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/translactam_amber_vacuo_mc.log
    26 Jul 2005: LT. 0.500E-01 CONF 1 E = 40.20 ( 0.043) rejected by energy CONF 1 E = 24.24 ( 0.123) is unique and stored as structure 12 CONF 1 E = ... 0.102) rejected by structure 16 CONF 1 E = -13.19 ( 0.631) rejected by starting geometry CONF 1 E = 24.24 ( 0.100)
  37. Archive: Chemical Informatics Letters

    https://www-jmg.ch.cam.ac.uk/CIL/archive/vol1_7.html
    27 Jul 2006: Chemical Informatics Letters. Editor:Volumes 1-7. Volume 7. (1). FDA: library of chemical information (July 2003). The US Food and Drug Administration now provides a library of chemical information. Isotope Effects Toolkit (July 2003). This web site
  38. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexN.html
    24 Aug 2007: Drug names (Chem. Inf. Lett. 2005, 10, #2, 24).
  39. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_amber_chcl3_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_amber_chcl3_mc.log
    26 Jul 2005: 3 CONF 1 E = -201.24 ( 0.607) is unique and stored as structure 4 Minimization converged; gradient = 0.398E-01. ... 0.161) replaces structure 24 CONF 1 E = -221.33 ( 0.425) rejected by starting geometry Minimization converged; gradient = 0.456E-01.
  40. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexM.html
    24 Aug 2007: Masters course in Chemical Informatics (Chem. Inf. Lett. 2005, 11, #2, 24). ... Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24).
  41. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm2_vacuo_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm2_vacuo_mc.log
    26 Jul 2005: LT. 0.500E-01 CONF 1 E = 62.24 ( 0.044) replaces structure 31 Minimization converged; gradient = 0.360E-01. ... LT. 0.500E-01 CONF 1 E = 62.24 ( 0.032) replaces structure 31 Minimization converged; gradient = 0.439E-01.
  42. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexP.html
    24 Aug 2007: PhysChem (Chem. Inf. Lett. 2007, 15, #2, 24). ... 2006, 12, #2, 24). Precedings.
  43. https://www-jmg.ch.cam.ac.uk/stuff/lactam/transtbutyl_mm3_vacuo_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/transtbutyl_mm3_vacuo_mc.log
    26 Jul 2005: LT. 0.500E-01 CONF 1 E = 154.00 ( 0.049) rejected by structure 24 Minimization converged; gradient = 0.380E-01. ... LT. 0.500E-01 CONF 1 E = 154.00 ( 0.028) rejected by structure 24 Minimization converged; gradient = 0.469E-01.
  44. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexI.html
    24 Aug 2007: Masters course in Chemical Informatics (Chem. Inf. Lett. 2005, 11, #2, 24).
  45. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm3_vacuo_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm3_vacuo_mc.log
    26 Jul 2005: LT. 0.500E-01 CONF 1 E = 129.82 ( 0.048) rejected by structure 24 Minimization converged; gradient = 0.481E-01. ... LT. 0.500E-01 CONF 1 E = 129.82 ( 0.027) replaces structure 24 Minimization converged; gradient = 0.438E-01.
  46. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexS.html
    24 Aug 2007: JoeLib (Chem. Inf. Lett. 2003, 6, #2, 24). ... Xdrawchem (Chem. Inf. Lett. 2007, 14, #2, 24). Chem. Inf. Lett.
  47. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm2_chcl3_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm2_chcl3_mc.log
    26 Jul 2005: 0.156) is unique and stored as structure 24 Minimization converged; gradient = 0.375E-01. ... LT. 0.500E-01 CONF 1 E = 6.97 ( 0.034) rejected by structure 24 Minimization converged; gradient = 0.316E-01.
  48. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexC.html
    24 Aug 2007: Masters course in Chemical Informatics (Chem. Inf. Lett. 2005, 11, #2, 24). ... collections. Chem. Inf. Lett. 2004, 8, #2, 24). Colours.
  49. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cisdimerbb_amber_chcl3_mc.lo…

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cisdimerbb_amber_chcl3_mc.log
    26 Jul 2005: 1.221) rejected by energy CONF 1 E = -458.36 ( 0.436) rejected by energy CONF 1 E = -425.24 ( 0.931) rejected by energy CONF 1 E = -394.07 ( ... 1 E = -538.24 ( 1.494) is unique and stored as structure 13 CONF 1 E = -484.74 ( 0.352) rejected by energy
  50. https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm3_chcl3_mc.log

    https://www-jmg.ch.cam.ac.uk/stuff/lactam/cislactam_mm3_chcl3_mc.log
    26 Jul 2005: LT. 0.500E-01 CONF 1 E = 98.24 ( 0.049) rejected by structure 13 Minimization converged; gradient = 0.426E-01. ... LT. 0.500E-01 CONF 1 E = 95.28 ( 0.034) replaces structure 24 Minimization converged; gradient = 0.315E-01.
  51. CIL Index

    https://www-jmg.ch.cam.ac.uk/CIL/autoindexall.html
    24 Aug 2007: Molecular Design Group at Trinity College Dublin (Chem. Inf. Lett. 2004, 8, #2, 24). ... Masters course in Chemical Informatics (Chem. Inf. Lett. 2005, 11, #2, 24).

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