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Hey! I was just trying to install the software (LINUX-X86_64-G95-MPI) and when I tried to make I realized the path for the FC and LD flags seem to be hardcoded in the makefile? Shouldn't they better u…
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Hi, I wonder whether DiffChIPL can produce the normalized log2CPM matrix through 2-7 step (from CPM normaliztion to differential analysis by limma) ?
And how to generate the normalize matrix with exp…
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@ladinesa @ndaelman-hu we can start parsing the k points into the `KMesh` method section. In order to not step in each others feet, I created a list to keep track of which one is parsed or not.
Met…
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(originally by @fgeorgatos)
this issue does not mean that guidelines have to be followed at 100% but,
there should be some good understanding if something obvious has to be adhered to:
http://www.hpc…
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I'm working at Vashishta's group and I showed them some benchmarks of `user-reaxc` on KOKKOS CUDA. On a 6 million atom system, `fix qeq` is ~75% of computation time (performed every step). One of the …
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Hello all,
this is an objective already covered at more than 50% level:
https://cug.org/proceedings/attendee_program_cug2012/includes/files/pap126.pdf
Namely, the applications & libraries that …
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See:
- https://github.com/molmod/molmod/tree/master/molmod/io
- https://github.com/molmod/molmod/tree/master/molmod/io/test
- https://github.com/molmod/molmod/tree/master/molmod/data/test
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**Date**: May 10th
**Time**: 1pm UK time ([other times](https://www.timeanddate.com/worldclock/meetingdetails.html?year=2022&month=5&day=10&hour=12&min=0&sec=0&p1=43&p2=136&p3=37&p4=771&p5=235&p6=152…
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This might be "controversial" but this would help make building easier for users (but life more difficult for developers)