Open Daily: 10am - 10pm | Alley door pickup 10am - 7pm 3038 Hennepin Ave Minneapolis, MN
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  • Open Daily: 10am - 10pm
    Alley-side Pickup: 10am - 7pm

    3038 Hennepin Ave Minneapolis, MN
    612-822-4611

Open Daily: 10am - 10pm | Alley-side Pickup: 10am - 7pm
3038 Hennepin Ave Minneapolis, MN
612-822-4611
Supercomputer and Chemistry: Iabg Workshop 1989

Supercomputer and Chemistry: Iabg Workshop 1989

Harms, Uwe

Paperback

ChemistryGeneral Computers

ISBN10: 3540529152
ISBN13: 9783540529156
Publisher: Springer Pg
Published: Sep 27 1990
Pages: 143
Weight: 0.56
Height: 0.33 Width: 6.69 Depth: 9.61
Language: English
Supercomputer and Chemistry is the name of a series of seminars, which the Industrieanlagen-Betriebsgesellschaft (IABG), Ottobrunn near Munich, started in 1987. This third meeting stressed the fields of computational science, supercomputing and computer-aided chemistry. Moreover, he current situation in the supercomputer market as a whole, particularly in Germany, and the trends to be expected were discussed. The new generation of graphic workstations such as StARDENT have the power of minisupercomputers. Some performance results are pre sented and comparisons with other machines are made. One of the most exciting prospects for improving the performance of computers is parallel processing. Especially, transputers seem to give unli mited computing speed, in effect a Crayon your desk. We examine the technology of transputers and their usage in industrial and research projects. The user will have a formidable task in paral lelizing software. The second part of the seminar addressed the usage of mainframes and supercomputers in the chemical industry. The interplay of ex periments and computer-aided drug design was highlighted by spea kers from Sandoz, Boehringer-Ingelheim and Merck. There is still one open question when using numerical methods, i.e. whether all the relevant and important conformations have been obtained. Cer tainly the computational results have to be checked and verified against experimental results. Furthermore, the benefits, disadvantages and the reduction in costs and time in using supercomputers in pharmaceutical research were discussed.

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