quantaosun Ambertools-OpenMM-MD issues

quantaosun / Ambertools-OpenMM-MD

Open Source, Mostly just clicking mouse to finish a simulation with Ambertools and OpenMM. It was designed to use locally but another notebook to finish the simulaiton on Colab was attached as well.

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issues

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Reminder:openmm import

#5 quantaosun opened 10 months ago
0
libstdc++.so.6: version GLIBCXX_3.4.30' not found

#4 quantaosun opened 10 months ago
0
Could not find prot_lig_prod_all.dcd

#3 pharm-dacnhan closed 1 year ago
2
input_parser.py ValueError: invalid literal for int() with base 10: ''

#2 mainguyenanhvu closed 1 year ago
0
How to run MMGBSA with OpenMM?

#1 mainguyenanhvu closed 1 year ago
13

quantaosun / Ambertools-OpenMM-MD

issues

Reminder:openmm import

libstdc++.so.6: version GLIBCXX_3.4.30' not found

Could not find prot_lig_prod_all.dcd

input_parser.py ValueError: invalid literal for int() with base 10: ''

How to run MMGBSA with OpenMM?