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  1. Results that match 1 of 2 words

  2. amino acids

    https://www-jmg.ch.cam.ac.uk/data/molecules/amino/
    18 Jul 2024: university of cambridge. amino acids. Leu. L. (CH. 3. ). 2. CHCH. 2. Ile. I. CH. 3. CH. 2. CH(CH. 3. ). Tyr. Y. HOC. 6. H. 4. CH. 2. Trp. W. Indole-CH. 2. Thr. T. CH. 3. CH(OH). Met. M. CH. 3. SCH. 2. CH. 2. Asn. N. H. 2. NCOCH. 2. Gln. Q. H. 2.
  3. Periodic Table

    https://www-jmg.ch.cam.ac.uk/tools/magnus/PeriodicTable.html
    18 Jul 2024: university of cambridge. Periodic Table. Sorry, your web browser does not support java. For best images, set your monitor to at least 256 colours. The data from this periodic table can be used to calculate a molecular weight from a formula and
  4. glucose

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/glucose.html
    18 Jul 2024: university of cambridge. glucose. SMILES. O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@]([H])(CO)O1. Canonical SMILES. OCC1OC(O)C(O)C(O)C1O. InChI. InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1.
  5. practical four: molecular dynamics

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/prac4.html
    18 Jul 2024: university of cambridge. practical four: molecular dynamics. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemical Information Laboratory. and this information is for historical interest only. Practical Four: Molecular Dynamics
  6. calcium hydroxide with six water molecules

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/caohoh.html
    18 Jul 2024: university of cambridge. calcium hydroxide with six water molecules. Notes. This structure comes from minimising the energy of a Ca(OH). 2. 6H. 2. O cluster using B3LYP. SMILES. [H]O[Ca]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H]. Canonical
  7. Alkanes which cannot be made

    https://www-jmg.ch.cam.ac.uk/publications/ci0497657.html
    18 Jul 2024: university of cambridge. Alkanes which cannot be made. What Is the Smallest Saturated Acyclic Alkane that Cannot Be Made? K. M. N. de Silva and J. M. Goodman J. Chem. Inf. Model. 2005, 45, 81-87. DOI: 10.1021/ci0497657. Related work:. 2005-2024;
  8. Solubility Challenge

    https://www-jmg.ch.cam.ac.uk/publications/ci800058v.html
    18 Jul 2024: university of cambridge. Solubility Challenge. Solubility Challenge: Can You Predict Solubilities of Thirty-Two Molecules Using a Database of One Hundred Reliable Measurements. A. Llinas, R. C. Glen, J. M. Goodman J. Chem. Inf. Model. 2008, 48,
  9. Molecular Square Host

    https://www-jmg.ch.cam.ac.uk/publications/ja801508q.html
    18 Jul 2024: university of cambridge. Molecular Square Host. Dynamic Combinatorial Discovery of a [2]-Catenane and its Guest-Induced Conversion into a Molecular Square Host. K. R. West, R. F. Ludlow, P. T. Corbett, P. Besenius, F. M. Mansfeld, P. A. G. Cormack,
  10. ribose

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/ribose.html
    18 Jul 2024: university of cambridge. ribose. Alternate names D-ribose. beta-ribose. D-β-ribose. SMILES. O[C@H]1[C@H](O)[C@H](O)[C@@H](CO)O1. Canonical SMILES. InChI. InChI=1/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5-/m1/s1.
  11. royal society of chemistry

    https://www-jmg.ch.cam.ac.uk/data/c2k/cj/rsc.html
    18 Jul 2024: university of cambridge. royal society of chemistry. was Chemistry in Britain). includes Faraday Transactions). merging Perkin I and Perkin II). Goodman Group, 2005-2024; privacy; last updated July 18, 2024.
  12. biphenyl

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/biphenyl.html
    18 Jul 2024: university of cambridge. biphenyl. SMILES. C1(C2=CC=CC=C2)=CC=CC=C1. Canonical SMILES. c1ccc(cc1)c2ccccc2. InChI. InChI=1/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H.
  13. contributors to acca

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/accadoc/history.html
    18 Jul 2024: university of cambridge. contributors to acca. Contributors to Acca. A number of people have worked on Acca.
  14. indigo unix notes

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/UnixNotes.html
    18 Jul 2024: university of cambridge. indigo unix notes. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemi cal Information Laboratory. and this information is for historical interest only. Indigo Unix Notes. Indigos run a windowing system,
  15. DL_POLY notes

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/dl_poly.html
    18 Jul 2024: university of cambridge. DL_POLY notes. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemi cal Information Laboratory. and this information is for historical interest only. DL_POLY Notes. DL_POLY is a parallel molecular
  16. NMR calculation

    https://www-jmg.ch.cam.ac.uk/publications/jo8003138.html
    18 Jul 2024: university of cambridge. NMR calculation. Stereostructure Assignment of Flexible Five-Membered Rings by GIAO. 13. C NMR Calculations: Prediction of the Stereochemistry of Elatenyne. S. G. Smith, R. S. Paton, J. W. Burton, and J. M. Goodman J. Org.
  17. 1,5-Anti Stereocontrol

    https://www-jmg.ch.cam.ac.uk/publications/jo701849x.html
    18 Jul 2024: university of cambridge. 1,5-Anti Stereocontrol. 1,5-Anti Stereocontrol in the Boron-Mediated Aldol Reactions of β-Alkoxy Methyl Ketones: The Role of the Formyl Hydrogen Bond. R. S. Paton and J. M. Goodman J. Org. Chem. 2008, 73, 1253-1263. This
  18. cyclohexane (chair)

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cyclohexane.html
    18 Jul 2024: university of cambridge. cyclohexane (chair). SMILES. C1CCCCC1. Canonical SMILES. C1CCCCC1. InChI. InChI=1/C6H12/c1-2-4-6-5-3-1/h1-6H2.
  19. american chemical society

    https://www-jmg.ch.cam.ac.uk/data/c2k/cj/acs.html
    18 Jul 2024: university of cambridge. american chemical society. Goodman Group, 2005-2024; privacy; last updated July 18, 2024.
  20. macroModel update

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/NewBmin.html
    18 Jul 2024: university of cambridge. macroModel update. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemi cal Information Laboratory. and this information is for historical interest only. MacroModel Update. If you do not understand any
  21. ISIS/draw and ISIS/base

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/MDL/mdl.html
    18 Jul 2024: university of cambridge. ISIS/draw and ISIS/base. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemical Information Laboratory. and this information is for historical interest only. ISIS/Draw and ISIS/Base. ISIS/Draw may be
  22. Hydrogen-bond stabilization in oxyanion holes

    https://www-jmg.ch.cam.ac.uk/publications/C2OB06717J.html
    18 Jul 2024: university of cambridge. Hydrogen-bond stabilization in oxyanion holes. How best to stabilise oxyanions with hydrogen bonds? The usual diagram for this shows a flat structure. Enzymes, however, prefer to place the hydrogen bonds at ninety degrees to
  23. norbornane

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/norbornane.html
    18 Jul 2024: university of cambridge. norbornane. SMILES. [C@H]12CC[C@@H](C2)CC1. Canonical SMILES. C1CC2CCC1C2. InChI. InChI=1/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2/t6-,7-.
  24. upgrade 1997

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/upgrade97.html
    18 Jul 2024: university of cambridge. upgrade 1997. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemi cal Information Laboratory. and this information is for historical interest only. Upgrade 1997. Some of the Silicon Graphics Teaching
  25. practical six: databases

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/prac6.html
    18 Jul 2024: university of cambridge. practical six: databases. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemical Information Laboratory. and this information is for historical interest only. Practical Six: Databases. (1) Searching the
  26. practical five: viewing orbitals and normal modes

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/prac5.html
    18 Jul 2024: university of cambridge. practical five: viewing orbitals and normal modes. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemical Information Laboratory. and this information is for historical interest only. Practical Five:
  27. adamantane

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/adamantane.html
    18 Jul 2024: university of cambridge. adamantane. SMILES. C1(C2)CC(CC2C3)CC3C1. Canonical SMILES. C1C2CC3CC1CC(C2)C3. InChI. InChI=1/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+.
  28. notes for new users

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/newuser.html
    18 Jul 2024: university of cambridge. notes for new users. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemi cal Information Laboratory. and this information is for historical interest only. Notes for New Users. Your account will give you
  29. Polymorph control

    https://www-jmg.ch.cam.ac.uk/publications/jdrudis200711006.html
    18 Jul 2024: university of cambridge. Polymorph control. Polymorph control: past, present and future. A. Llinas and J. M. Goodman Drug Discovery Today 2008, 13, 198-210. DOI: 10.1016/j.drudis.2007.11.006. Other papers on solubility and polymorphs include:.
  30. decalin (cis)

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cisdecalin.html
    18 Jul 2024: university of cambridge. decalin (cis). SMILES. [H][C@@]12[C@@](CCCC2)([H])CCCC1. Canonical SMILES. C1CCC2CCCCC2C1. InChI. InChI=1/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/t9-,10+.
  31. cyclohexene

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cyclohexene.html
    18 Jul 2024: university of cambridge. cyclohexene. SMILES. C1C=CCCC1. Canonical SMILES. C1CCC=CC1. InChI. InChI=1/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2.
  32. polyketides

    https://www-jmg.ch.cam.ac.uk/data/molecules/polyketides/
    18 Jul 2024: university of cambridge. polyketides. Goodman Group, 2005-2024; privacy; last updated July 18, 2024.
  33. c60

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/c60.html
    18 Jul 2024: university of cambridge. c60. SMILES. C12=C(C3=C4C5=C67)C8=C9C%10=C1C(C%11=C%12%13)=C%14C%10=C(C%15=C%16C%17=C%18C%19=C%20C%21=C%18C%22=C%16C%23=C%24C%15=C%14C%13=C%24C%25=C%26C%23=C%22%27)C%17=C9C%19=C8C4=C%20C5=C%28C%21=C%27C%29=C%26C%30=C%25C%12=C
  34. practical one: building molecules

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/prac1.html
    18 Jul 2024: university of cambridge. practical one: building molecules. The Silicon Graphics Teaching Laboratory. has been replaced by the. Chemical Information Laboratory. and this information is for historical interest only. Practical One: Building Molecules.
  35. #sketchBINOL

    https://www-jmg.ch.cam.ac.uk/publications/sketchBINOL.html
    18 Jul 2024: university of cambridge. sketchBINOL. How best to sketch BINOL, and BINOL-derived catalysts, to illustrate how its shape can transfer stereogenic information to substrates? The above diagram is consistent with the view of BINOL we have used in:. 2005
  36. alphabetical list of countries

    https://www-jmg.ch.cam.ac.uk/data/c2k/c2knation.html
    18 Jul 2024: university of cambridge. alphabetical list of countries. c2k - Alphabetical List of Countries. Total number of countries: 138. Total number of departments: 1857. Democratic Republic of the Congo 1. United States of America 642. Zimbabwe 1. Goodman
  37. countries in order of number of departments

    https://www-jmg.ch.cam.ac.uk/data/c2k/c2knumber.html
    18 Jul 2024: university of cambridge. countries in order of number of departments. c2k - Countries in Order of Number of Departmnets. Total number of countries: 138. Total number of departments: 1857. United States of America 642. Democratic Republic. of the
  38. cyclopentane

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cyclopentane.html
    18 Jul 2024: university of cambridge. cyclopentane. SMILES. C1CCCC1. Canonical SMILES. C1CCCC1. InChI. InChI=1/C5H10/c1-2-4-5-3-1/h1-5H2. AuxInfo=1/0/N:1,2,5,3,4/E:(1,2,3,4,5)/rA:5nCCCCC/rB:s1;s2;s3;s1s4;/rC:-.4125,-.6348,0;.4125,-.6348,0;.6674,.1498,0;0,.6348,0;
  39. cycloheptane (conformation one)

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cycloheptane.html
    18 Jul 2024: university of cambridge. cycloheptane (conformation one). SMILES. C1CCCCCC1. Canonical SMILES. C1CCCCCC1. InChI. InChI=1/C7H14/c1-2-4-6-7-5-3-1/h1-7H2. AuxInfo=1/0/N:1,2,7,3,6,4,5/E:(1,2,3,4,5,6,7)/rA:7nCCCCCCC/rB:s1;s2;s3;s4;s5;s1s6;/rC:-.7127,.5376
  40. galactose

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/galactose.html
    18 Jul 2024: university of cambridge. galactose. Notes D-Galactose is a common naturally-occuring sugar. SMILES. O[C@H]1[C@@H](CO)O[C@H](O)[C@H](O)[C@H]1O. Canonical SMILES. InChI. InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6+/m1/s1.
  41. Instructions for the calculation of CP3

    https://www-jmg.ch.cam.ac.uk/tools/nmr/instructions.html
    18 Jul 2024: university of cambridge. CP3 calculation. How do I calculate CP3? CP3 is a parameter which helps to assign structure and stereochemistry by comparing experimental and calculated NMR spectra. The calculation of CP3 is a three step process:. Enter
  42. tamiflu

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/tamiflu.html
    18 Jul 2024: university of cambridge. tamiflu. Alternate names. oseltamivir. Literature. Tamiflu is a treatment for flu, which inhibits neuraminidase. Review:. The synthetic development of the anti-influenza neuraminidase inhibitor oseltamivir phosphate (Tamiflu)
  43. decalin (trans)

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/transdecalin.html
    18 Jul 2024: university of cambridge. decalin (trans). SMILES. [H][C@@]12[C@](CCCC2)([H])CCCC1. Canonical SMILES. C1CCC2CCCCC2C1. InChI. InChI=1/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/t9-,10-.
  44. Dolabriferol

    https://www-jmg.ch.cam.ac.uk/publications/anie201109080.html
    18 Jul 2024: university of cambridge. Dolabriferol. In 1996, we predicted that it should be possible to make dolabriferol by this pathway, after a computational analysis of the many competing processes that could result from the rearrangement (Org. Lett. 2005, 7,
  45. taxol

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/taxol.html
    18 Jul 2024: university of cambridge. taxol. SMILES. CC1=C([C@@H](OC(C)=O)C2=O)C(C)(C)[C@@]([C@@H](OC(C3=CC=CC=C3)=O)[C@@]4([H])[C@@]2(C)[C@@H](O)C[C@@H]5[C@@]4(OC(C)=O)CO5)(O)C[C@@H]1OC([C@H](O)[C@@H](NC(C6=CC=CC=C6)=O)C7=CC=CC=C7)=O. Canonical SMILES.
  46. cycloheptane (conformation two)

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/cycloheptane2.html
    18 Jul 2024: university of cambridge. cycloheptane (conformation two). SMILES. C1CCCCCC1. Canonical SMILES. C1CCCCCC1. InChI. InChI=1/C7H14/c1-2-4-6-7-5-3-1/h1-7H2. AuxInfo=1/0/N:1,2,7,3,6,4,5/E:(1,2,3,4,5,6,7)/rA:7nCCCCCCC/rB:s1;s2;s3;s4;s5;s1s6;/rC:-.7127,.5376
  47. c70

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/c70.html
    18 Jul 2024: university of cambridge. c70. SMILES.
  48. Amino Acids

    https://www-jmg.ch.cam.ac.uk/tools/magnus/molecules/amino/
    18 Jul 2024: university of cambridge. Amino Acids. Leu. L. (CH. 3. ). 2. CHCH. 2. Ile. I. CH. 3. CH. 2. CH(CH. 3. ). Tyr. Y. HOC. 6. H. 4. CH. 2. Trp. W. Indole-CH. 2. Thr. T. CH. 3. CH(OH). Met. M. CH. 3. SCH. 2. CH. 2. Asn. N. H. 2. NCOCH. 2. Gln. Q. H. 2.
  49. metolachlor

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/metolachlor.html
    18 Jul 2024: university of cambridge. metolachlor. Alternate names aS,5S metolachlor. Notes Metolachlor is a pesticide which has a chiral centre and also shows axial chirality. The latter does no appear to have a big effect on its activity, but the S form is
  50. bicyclo[2.2.2]octane

    https://www-jmg.ch.cam.ac.uk/data/molecules/misc/bicyclooctane.html
    18 Jul 2024: university of cambridge. bicyclo[2.2.2]octane. SMILES. [H][C@@]1(CC2)CC[C@]2([H])CC1. Canonical SMILES. C1CC2CCC1CC2. InChI. InChI=1/C8H14/c1-2-8-5-3-7(1)4-6-8/h7-8H,1-6H2/t7-,8+. AuxInfo=1/0/N:8,4,5,7,1,3,6,2/E:(1,2,3,4,5,6)(7,8)/rA:10nCCCCCCCCHH/rB
  51. COMM

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/accadoc/comm.html
    18 Jul 2024: university of cambridge. COMM. COMM. COMM. introduces a comment. The rest of the line is ignored. Acca and Acca documentation: 1996,1997 J M Goodman, Cambridge. Acca documentation may not be copied without the written permission of the author.

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