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I was able to download the sample data and run a sort on it successfully. Opening it in the manual clustering suite also worked very well. However I cannot export to phy. I get the following error mes…
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**Github username:** @0xRizwan
**Submission hash (on-chain):** 0xdf90f41d0ea2fd60a123dc646dd1e33b82f1c52a0ff35bb512eb5d1a1f09638f
**Severity:** low
**Description:**
**Description**\
**Issue 1**
In…
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charmm interface FF from charmm-gui
the rtf like this:
> * INTERFACE FF
> * topology for nanomaterials
> *
> 36 1
the prm title:
> * INTERFACE FF
> * topology and parameter for caly m…
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It would be great to have a variation of convection-box.prm that is periodic in x. Maybe a slight variation (wider than high?)?
tjhei updated
4 years ago
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Some of the programs have bugs. They flag composite numbers as primes, and fail to detect known primes. Until these bugs are fixed, there is not much point to comparing run times with those of other p…
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Hi resal81 and everyone,
I had a similar problem to that of krlitros87 (https://github.com/resal81/PyTopol/issues/23).
I have a system composed by a membrane protein in which several ions ( K+, Na+, C…
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Hi,
this is a feature request for the integration of Params and https://github.com/carlobaldassi/ArgParse.jl. It would be nice to be able to define an ArgParse table from a `@with_kw` struct. My macr…
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While performing **organize_files_tops_linux.csh filelist ../reframed/pins.ll 1** I am getting the following error:
/home/contec/Softwares/GMTSAR/bin/SAT_llt2rat: 1: /bin: Permission denied
/home…
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For Moxonidine example where there is a BLOCK(2) on CL and V the .ext file has the full OMEGA matrix, but apart from the CL, V block there are no other named OMEGAs in the control stream.
`get_prm` f…
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@dmaddoxwhite @lymereJ @weilixu
In `model_differentiate_primary_secondary_thermal_zones`, it appears that both the maximum internal load check *AND* the equivalent full-load hours check are used t…