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Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v3n3.html21 Apr 2013: The most recent opinion "The future of the electronic scientific literature" concludes that diversity is required and it would be unwise to be limited to a single economic or technological method. ... But is it? What would constitute a fair test? When -
Chemists in the UK (by Department)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList31.html6 May 2024: university of cambridge. Chemists in the UK (by Department). Armenia - National Academy of Sciences of Armenia. Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol1_7.html27 Jul 2006: ICSTI (June 2003). The International Council for Scientific and Technical Information (ICSTI) has the mission of promoting recognition of the value of scientific and technical information to the world's economic, -
Chemists in the Rest of the World (by Name)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList30.html6 May 2024: university of cambridge. Chemists in the Rest of the World (by Name). Rest of World. Zulalyan M.K. - Armenia - National Academy of Sciences of Armenia. Sargsyan G.Kh. - Armenia - National Academy of Sciences of Armenia. Nersisyan M.G. - Armenia - Results that match 1 of 2 words
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Chemists in the UK (by Department)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList2122.html6 May 2024: university of cambridge. Chemists in the UK (by Department). Louisiana - Centenary College of Louisiana. Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Molecular Formula
https://www-jmg.ch.cam.ac.uk/tools/magnus/EadFormW.html6 May 2024: C. 2. H. 10. cannot exist, therefore. The test is approximate, and is likely to allow some improbable molecules. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v4n1.html21 Apr 2013: and economic needs of developing countries. -
VAMP notes
https://www-jmg.ch.cam.ac.uk/cil/SGTL/vamp.html6 May 2024: Example data files are in. /usr/bigdisk/om/VAMP/TESTS. The file format is very similar to MOPAC so the conversion programs for MOPAC can also be used for VAMP. -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol13.html5 Jan 2007: The CoEPrA (Comparative Evaluation of Prediction Algorithms) 2006 competition started on April 17, 2006, providing a test for classification and regression algorithms in chemical informatics. ... Comparison of different virtual screening methods is hard, -
Chemists in the UK (by Department)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList2240.html6 May 2024: university of cambridge. Chemists in the UK (by Department). New York - St Lawrence. Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v6n6.html21 Apr 2013: The International Council for Scientific and Technical Information (ICSTI) has the mission of promoting recognition of the value of scientific and technical information to the world's economic, research, scholarly and -
mm2pov Help Page
https://www-jmg.ch.cam.ac.uk/cil/SGTL/mm2povhelp.html7 Apr 2013: test.dat - a test molecule. test.pov - what mm2pov should produce on the test molecule. -
Chemists in the UK (by Department)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList2296.html6 May 2024: university of cambridge. Chemists in the UK (by Department). Pennsylvania - Lehigh. Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v16n3.html29 Sep 2008: PRISM is the Partnership for Research Integrity in Science and Medicine which was "formed to advocate for policies that ensure the quality, integrity, and economic viability of peer-reviewed journals" which -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol10.html27 Jul 2006: Professor Tudor Oprea believes so, and has arranged for a challenge to test this. ... The same five test acronyms gave identical results, except for DFT, which only found thirteen suggestions - all except one of which were chemistry-focussed. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v9n2.html21 Apr 2013: A new test version (documentation and sample structure files, but Microsoft Windows only) of the IUPAC-NIST Chemical Identifier (INChI) is now available. -
kinetics notes
https://www-jmg.ch.cam.ac.uk/tools/magnus/kineticnotes.html6 May 2024: 1. if the initial concentration is not zero. This seems a stringent test. -
Chemists in the UK (by Department)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList311.html6 May 2024: university of cambridge. Chemists in the UK (by Department). Australia - La Trobe. Goodman Group, 2005-2024; privacy; last updated May 6, 2024. -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol9.html27 Jul 2006: A new test version (documentation and sample structure files, but Microsoft Windows only) of the IUPAC-NIST Chemical Identifier (INChI) is now available. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v2n3.html21 Apr 2013: Web access to a database of spectra. Free access to about 5000 spectra in order to test the service. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v5n3.html21 Apr 2013: ACD believes that it is, and is looking for data to test their programs. -
Archive: Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/archive/vol11.html27 Jul 2006: The Royal Society of Arts has launched the Adelphi Charter on Creativity, Innovation and Intellectual Property calling for a public interest test should be applied before granting intellectual property rights. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v13n3.html24 Aug 2007: The CoEPrA (Comparative Evaluation of Prediction Algorithms) 2006 competition started on April 17, 2006, providing a test for classification and regression algorithms in chemical informatics. -
Chemists in the USA (by Name)
https://www-jmg.ch.cam.ac.uk/data/c2k/people/StaffList/StaffList20.html6 May 2024: economics-mathematic.> - New York - St Lawrence. -
https://www-jmg.ch.cam.ac.uk/CIL/rss/all.xml
https://www-jmg.ch.cam.ac.uk/CIL/rss/all.xml24 Aug 2007: no agreement on an ideal diverse test set. ... v13n3.html#31 The CoEPrA (Comparative Evaluation of Prediction Algorithms) 2006 competition started on April 17, 2006, providing a test for classification and regression algorithms in chemical. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v2n2.html21 Apr 2013: The mathematics mark up language test suite was released in December 2000. -
list of software
https://www-jmg.ch.cam.ac.uk/cil/SGTL/software.html6 May 2024: usr/bigdisk/om/VAMP/TESTS. The file format is very similar to MOPAC (and the program works in a similar way), so the conversion programs for MOPAC can also be used -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v13n5.html24 Aug 2007: Comparison of different virtual screening methods is hard, partly because there is no agreement on an ideal diverse test set. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v10n4.html24 Aug 2007: Professor Tudor Oprea believes so, and has arranged for a challenge to test this. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v11n4.html24 Aug 2007: The Royal Society of Arts has launched the Adelphi Charter on Creativity, Innovation and Intellectual Property calling for a public interest test should be applied before granting intellectual property rights. -
DOCK 2 MOLECULES: This docker brings one movable (but ...
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_dk.html8 Nov 2010: We have had occasion to test what happens to occluded systems - a solvent caught inside a cage zeolite or 'Rebek Tennis Ball'. -
Chemical Informatics Letters
https://www-jmg.ch.cam.ac.uk/CIL/cil_v10n6.html24 Aug 2007: The same five test acronyms gave identical results, except for DFT, which only found thirteen suggestions - all except one of which were chemistry-focussed. -
Page 4: Boron-Mediated Aldol Reactions
https://www-jmg.ch.cam.ac.uk/stuff/ECTOC3/p4.html6 May 2013: Chiral Ketones. The most severe test of the new procedure is to apply it to chiral ketones. -
8) Appendices
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xa1_br.html8 Nov 2010: 8) Appendices. APPENDIX 1A DRAWING EXERCISE. This exercise is to demonstrate how the DRAW window works and tests whether the modelling system can verify Bredt's Rule. -
mm2pov Help Page for the SGTL
https://www-jmg.ch.cam.ac.uk/cil/SGTL/mm2povhelp_SGTL.html7 Apr 2013: You can now run POV with. povray i[filename] d. for a test run and. -
CIL Glossary
https://www-jmg.ch.cam.ac.uk/CIL/gloss.html28 Apr 2013: The ACID test for a database transaction requires: (i) Atomic - a transaction either succeeds completely, or fails completely, so the database is not left in a half-updated state. -
CONFORMATION HUNTER: (see Appendix4) The hunter takes the screen ...
https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_ch.html8 Nov 2010: If you believe that no conformations above a certain limit (say 3kcals/mole) will ever be accommodated by your chosen receptor or enzyme, then now is the chance to test you
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