AMBER Archive (2004)

Subject: Re: AMBER: Mac OSX xleap compilation

From: Yusuf Abdulghani (yaghani_at_mac.com)
Date: Fri Apr 02 2004 - 13:16:14 CST


Hi Mengjuei,

> Just remember to setenv VENDOR_BLAS and VENDOR_LAPACK, also add
> "-framework Accelerate" to LOADLIB variable.
I am wondering where and why should these variables be set? Should
these variables be set in the MACHINE file? I dont see these variables
being used in any place in AMBER.

Thanks.

Yusuf

On Apr 1, 2004, at 11:19 PM, Mengjuei Hsieh wrote:

> Dear Dr. Pantano,
>
> How about the command "make World" under src/leap directory?
>
> For optimization, you can use link apple's lapack/blas library for a
> little
> boost. Just remember to setenv VENDOR_BLAS and VENDOR_LAPACK, also add
> "-framework Accelerate" to LOADLIB variable.
>
> Honestly, I would rather use IBM's compiler than g77 if you are really
> serious about the speed on G5.
>
> Best,
> --
> Mengjuei Hsieh
>
> on 4/1/04 10:32 PM, Sergio Pantano at spanta_at_sissa.it wrote:
>> Hi all,
>> I tried to install Amber 7 on a G5 using g77 compiler, everithing
>> fine but
>> xleap, it seems to be that the command imake is not recognized.
>> I have installed the last version of Apple's X11 with SDK.
>> Does anybody have an idea of how to fix it?
>> Thanks!
>> By the way, compliations flags to speed up the code are also welcome!
>> by
>> Sergio
>
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