>
> On 9/3/15 9:14 AM, Atsutoshi Okabe wrote:
>> Thanks, Justin.
>> I tried turning [bonds], [angles], [dihedrals] interaction on one-by-one.
>> However, same errors occurred in all cases.
>> Also, I tried the calculation on 1 cpu using the following command and the
&
t;
> On 9/2/15 10:21 AM, Atsutoshi Okabe wrote:
>> I mean that the entire [intermolecular_interaction] directive were commented
>> out below;
>> ;[ intermolecular-interactions ]
>>
I tried turning [bonds] or [angles] or [dihedrals] interaction on one-by-one.
How
; のメール：
>
>
> On 9/1/15 10:12 AM, Atsutoshi Okabe wrote:
>> Thanks, Justin.
>> I want to add restraint between protein and receptor using
>> [intermolecular-interactions] section(not comment out [bonds], [angles]
>> [dihedrals] lines)in new support tool of GROMACS 5.1.
>&g
/01 11:17、Justin Lemkul <jalem...@vt.edu> のメール：
>
>
> On 8/31/15 11:20 AM, Atsutoshi Okabe wrote:
>> Hi all,
>>
>> I have a question about how to use inter-molecular bonded interaction tool
>> in GROMACS 5.1.
>> I want to calculate binding
the
ligand-receptor interaction are completely turned off.)
Could you advice me how to solve this error?
Thank you,
Atsutoshi Okabe
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Thanks, Mark.
I inserted quotation in line 52 as Mark suggested.
I tried cmake again and got the only error.
Boost = 1.44 not found. Using minimal internal version. This may cause trouble
if you plan on compiling/linking other software that uses Boost against GROMACS.
I don't know what the
