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Analyzed about 11 hours ago. based on code collected about 11 hours ago.
Mar 04, 2025 — Mar 04, 2026
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
ala50 - a BIG system (512 atoms)!
Sandeep Somani
More... about 13 years ago
tetraala example (52 atoms)
Sandeep Somani
More... about 13 years ago
added better step taking with optimal parameters for tip4p example
Victor Rühle
as Victor Ruehle
More... about 13 years ago
minpermdist + exact match working for aa including molecular symmetry
Victor Rühle
as Victor Ruehle
More... about 13 years ago
rigid bodies automatically determine molecular symmetry
Victor Rühle
as Victor Ruehle
More... about 13 years ago
fixed that minpermdist could raise an excaption in some cases
Victor Rühle
as Victor Ruehle
More... about 13 years ago
Merge branch 'master' of https://github.com/js850/PyGMIN
Victor Rühle
as Victor Ruehle
More... about 13 years ago
fixed bug in exact_match with transposed rotation matrix
Victor Rühle
as Victor Ruehle
More... about 13 years ago
gui loads minima from database faster
Jacob Stevenson
More... about 13 years ago
Merge branch 'master' of github.com:js850/PyGMIN
Jacob Stevenson
More... about 13 years ago
fix amber/driverr.py
Jacob Stevenson
More... about 13 years ago
Merge branch 'master' of github.com:js850/PyGMIN
Sandeep Somani
More... about 13 years ago
(minor) updated comments
Sandeep Somani
More... about 13 years ago
change default to niter=10 in stochastic minpermdist
Jacob Stevenson
More... about 13 years ago
Merge branch 'master' of github.com:js850/PyGMIN
Jacob Stevenson
More... about 13 years ago
fix gui list sorting issue
Jacob Stevenson
More... about 13 years ago
fixes for amber system
Jacob Stevenson
More... about 13 years ago
(minor) updated comments
Sandeep Somani
More... about 13 years ago
added copyToLocalCoords function to fix a bug in writing pdb files for loading into pymol
Sandeep Somani
More... about 13 years ago
fixed bug with default value in config
Victor Rühle
as Victor Ruehle
More... about 13 years ago
Merge branch 'master' of https://[email protected]/js850/PyGMIN.git
Victor Rühle
as Victor Ruehle
More... about 13 years ago
fixed non-critical bug in exact match for double indices
Victor Rühle
as Victor Ruehle
More... about 13 years ago
update documentation for disconnectivity graph
Jacob Stevenson
More... about 13 years ago
fixed bug in standard align iteration
Victor Rühle
as Victor Ruehle
More... about 13 years ago
Merge branch 'master' of https://[email protected]/js850/PyGMIN.git
Victor Rühle
as Victor Ruehle
More... about 13 years ago
Amber potential class wrapping over OpenMM
Sandeep Somani
More... about 13 years ago
minor edits
Sandeep Somani
More... about 13 years ago
Merge branch 'master' of github.com:js850/PyGMIN
Sandeep Somani
More... about 13 years ago
run_gui can now take a database file as input to be loaded at startup
Sandeep Somani
More... about 13 years ago
added a comment
Sandeep Somani
More... about 13 years ago