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GunnerLab
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Stable-MCCE
Stable version of MCCE.
MIT License
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added mostocc.py
#201
newbooks
closed
3 years ago
0
added mostocc.py
#200
newbooks
closed
3 years ago
0
improved fort38_distance.py and bug fix on diff_mce.py
#199
newbooks
closed
3 years ago
0
added distance calculation, closes #197
#198
newbooks
closed
3 years ago
0
Analyze difference between two fort.38 files by Bhattachayya distance
#197
newbooks
closed
3 years ago
0
Hotfix wiki
#196
newbooks
closed
3 years ago
0
added WSL for WIndows
#195
newbooks
closed
3 years ago
0
Add documentation on installing mcce for Windows
#194
newbooks
closed
3 years ago
0
update
#193
newbooks
closed
3 years ago
0
added group by confid function
#192
newbooks
closed
3 years ago
0
integer_t1m
#191
judywei2333
closed
3 years ago
0
added msa
#190
newbooks
closed
3 years ago
0
updated ms_analysis
#189
newbooks
closed
3 years ago
0
Issue#184
#188
newbooks
closed
3 years ago
0
Ftpl update
#187
judywei2333
closed
3 years ago
0
added diff_mc.py
#186
newbooks
closed
3 years ago
0
update_tov
#185
judywei2333
closed
3 years ago
0
microstate analysis library
#184
newbooks
closed
3 years ago
0
updated wiki
#183
newbooks
closed
3 years ago
0
Charge ftpl
#182
judywei2333
closed
3 years ago
0
just_test
#181
judywei2333
closed
3 years ago
0
Newwork
#180
judywei2333
closed
3 years ago
0
closes #178
#179
newbooks
closed
3 years ago
0
Add a secondary param directory, prepare for conda package
#178
newbooks
closed
3 years ago
0
A quick question about bkn contribution to the calculated Em
#177
ghost
closed
3 years ago
1
name.txt should be modified
#176
yzhang9404
closed
1 year ago
0
Expand verify_ftpl.py to check all common errors
#175
newbooks
closed
1 year ago
0
add no3, closes #173
#174
newbooks
closed
4 years ago
0
add no3.ftpl
#173
newbooks
closed
4 years ago
0
.
#172
judywei2333
closed
4 years ago
0
New ftpl
#171
judywei2333
closed
4 years ago
0
updated rxn02
#170
newbooks
closed
4 years ago
0
switching to new ms_out
#169
newbooks
closed
4 years ago
0
added log analyzer, and switched new format for step 6
#168
newbooks
closed
4 years ago
0
update
#167
newbooks
closed
4 years ago
0
Fix cys
#166
newbooks
closed
4 years ago
0
fixed hem-lig-pw.py, closes #164
#165
newbooks
closed
4 years ago
0
Fix HEM to ligand pairwise interaction for multi-hem proteins
#164
newbooks
closed
4 years ago
0
Quickfix
#163
judywei2333
closed
4 years ago
0
add some ftpl files
#162
yzhang9404
closed
4 years ago
0
Add ftpl files
#161
yzhang9404
closed
4 years ago
0
Issue#159
#160
newbooks
closed
4 years ago
0
Fix vdw program Python 2 to Python 3 print statement
#159
newbooks
closed
4 years ago
0
identify heme ligands in step1.py, closes #155
#158
newbooks
closed
4 years ago
0
revised getpdb
#157
newbooks
closed
4 years ago
0
Update getpdb
#156
newbooks
closed
4 years ago
1
Identify HIL and MEL in step1
#155
newbooks
closed
4 years ago
0
fixed rotamers.c index ir=0 ir-1 error
#154
newbooks
closed
4 years ago
0
added jupyter nootbook example
#153
newbooks
closed
4 years ago
0
fixed wrong missing atom name in rotamer.c closes #151
#152
newbooks
closed
4 years ago
0
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