Support for tpx version 138 GROMACS v2026.1 #5364
saurav7007
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It may not be in a stable release yet, but support was added in #5219, so you could always install from the |
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Old Reference Ticket: #4888
Error:
ERROR loading TPR/XTC: Failed to construct topology from file results_20260403_221713/03_mdsim_protLig/CYP6M2_md.tpr with parser <class 'MDAnalysis.topology.TPRParser.TPRParser'>.
Error: Your tpx version is 138, which this parser does not support, yet
Requirement & Request:
Support for tpx version 138 GROMACS v2026.1
Background:
I was working on GROMACS v2026.1, which generates a topology file (tpx version=138). Now my earlier code for ProLIF, which runs mdAnalysis in the background for fingerprint generation, is not working.
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