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41 - 50 of 143 search results for TALK:PC53 20 |u:www-wales.ch.cam.ac.uk where 0 match all words and 143 match some words.

  1. Results that match 1 of 2 words

  2. Energy Landscapes: Frequently Asked Questions Thermodynamics The…

    https://www-wales.ch.cam.ac.uk/FAQ.pdf
    4 May 2024: 17] D. J. Wales, Curr. Opin. Struct. Biol. 20, 3 (2010). ... 20] T. V. Bogdan, D. J. Wales and F. Calvo, J.

  3. The data file

    https://www-wales.ch.cam.ac.uk/GMIN.doc/node7.html
    6 Jun 2024: AMBER 20 requires an additional input file,. min.in. , which specifies keywords for the AMBER 12 potential. ... and. coords.inpcrd. respectively. For details, see the AMBER 20 manual. As with the AMBER 9 interface, cutoffs are smoothed, using the.

  4. Index of /examples/OPTIM/checkperm/1bdd

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/checkperm/1bdd/
    2023-11-16 20:34. -. 2023-11-10 09:43. 3.3K.

  5. Index of /examples/GMIN/GMIN.peptide.dimer

    https://www-wales.ch.cam.ac.uk/examples/GMIN/GMIN.peptide.dimer/
    Index of /examples/GMIN/GMIN.peptide.dimer. 2022-12-22 20:45. 1.2K. ... 2022-12-22 20:44. 792. Apache/2.4.41 (Ubuntu) Server at www-wales.ch.cam.ac.uk Port 443.

  6. Index of /examples/OPTIM/M1NT.example.1step

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/M1NT.example.1step/
    Index of /examples/OPTIM/M1NT.example.1step. 2023-07-08 20:53. 153. ... 2023-07-08 20:50. 183K. Apache/2.4.41 (Ubuntu) Server at www-wales.ch.cam.ac.uk Port 443.

  7. Index of /examples/OPTIM/M1NT.example.2step

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/M1NT.example.2step/
    2023-07-08 20:51. 9.6K. ... 2023-07-08 20:51. 183K. Apache/2.4.41 (Ubuntu) Server at www-wales.ch.cam.ac.uk Port 443.

  8. Index of /examples/OPTIM/M1NT.example.3step

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/M1NT.example.3step/
    2023-07-08 20:51. 9.6K. ... 2023-07-08 20:51. 183K. Apache/2.4.41 (Ubuntu) Server at www-wales.ch.cam.ac.uk Port 443.

  9. Index of /examples/OPTIM/M1NT.example.6step

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/M1NT.example.6step/
    Index of /examples/OPTIM/M1NT.example.6step. 2023-07-08 20:14. 888. ... 2023-07-08 20:14. 2.8M.

  10. Index of /examples/OPTIM/tau_redopath.A9

    https://www-wales.ch.cam.ac.uk/examples/OPTIM/tau_redopath.A9/
    2019-03-22 14:20. 21K.

  11. The Cambridge Energy Landscape Database

    https://www-wales.ch.cam.ac.uk/~wales/CCD/ArNO.html
    26 Feb 2018: 18. -0.826280 eV. 19. -0.877617 eV. 20. -0.930506 eV. 21. -0.984059 eV.

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