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seanma...@gmail.com
10/17/18
[PLEASE READ] Welcome to the INDUS Users Forum!
Hi, everyone, My name is Sean Marks, and I'm the developer of the INDUS code. Please use this
unread,locked,
[PLEASE READ] Welcome to the INDUS Users Forum!
Hi, everyone, My name is Sean Marks, and I'm the developer of the INDUS code. Please use this
10/17/18
Leon Cole
6/29/23
MPI error Plumed 2.4 patched with GROMACS 2016.4
Hey guys! So I'm running a version of Plumed (2.4)+INDUS (a code for indirect Umbrella sampling)
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MPI error Plumed 2.4 patched with GROMACS 2016.4
Hey guys! So I'm running a version of Plumed (2.4)+INDUS (a code for indirect Umbrella sampling)
6/29/23
Leon Cole
6/28/23
Issues post processing a trajectory with the driver
Hey! I'm having issues using the plumed driver to post process an xtc trajectory file. Heres the
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Issues post processing a trajectory with the driver
Hey! I'm having issues using the plumed driver to post process an xtc trajectory file. Heres the
6/28/23
Mayank Vats
8/17/21
Problems compiling plumed 2.7.1 after patching INDUS
I am trying to compile Plumed 2.7.1 and Indus for patching into gromacs 2021.2. I had to make some
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Problems compiling plumed 2.7.1 after patching INDUS
I am trying to compile Plumed 2.7.1 and Indus for patching into gromacs 2021.2. I had to make some
8/17/21
anku...@gmail.com
3/11/21
Indus NVT | Buffering vapor liquid interface
Hello Sean and Indus group, Firstly, thank you for creating this platform and sharing the code on
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Indus NVT | Buffering vapor liquid interface
Hello Sean and Indus group, Firstly, thank you for creating this platform and sharing the code on
3/11/21
Mayank Vats
,
seanma...@gmail.com
3
10/5/20
Bulk water example in the manual
I recall now that you posted this question at a time before I included the sample input files in the
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Bulk water example in the manual
I recall now that you posted this question at a time before I included the sample input files in the
10/5/20
Mayank Vats
,
Sean Marks
6
5/30/19
Installation Troubleshooting -- IndusInterface.cpp:148:77: error
Great news! Yeah, trying to use PLUMED as a static library can be complicated. I usually use it as a
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Installation Troubleshooting -- IndusInterface.cpp:148:77: error
Great news! Yeah, trying to use PLUMED as a static library can be complicated. I usually use it as a
5/30/19
Camille Bilodeau
,
seanma...@gmail.com
7
11/19/18
Installation Troubleshooting: xdrfiletools.h
With the recent fixes, I was able to compile both the release and developer versions with MPI and
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Installation Troubleshooting: xdrfiletools.h
With the recent fixes, I was able to compile both the release and developer versions with MPI and
11/19/18