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StollLab
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chiLife
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Fix bug breaking ala and gly rotamer ensembels when eval_clash = True
Test on PR activity
#258:
Pull request
#207
opened by
mtessmer
3m 50s
mutat_ala_gly
mutat_ala_gly
3m 50s
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Fix rotamer shuffle when repairing PDB structures pre-repack.
Test on PR activity
#257:
Pull request
#206
opened by
mtessmer
4m 46s
fix/mutate-fill-missing-atoms
fix/mutate-fill-missing-atoms
4m 46s
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Fix bugs in cif and sdf readers/writers
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#256:
Pull request
#205
opened by
mtessmer
4m 53s
cif_edge_cases
cif_edge_cases
4m 53s
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Fix bug sometimes skipping peptide bond when using bio ccd to infer bonds.
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#255:
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#203
synchronize by
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5m 20s
ccd_peptide_bond
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5m 20s
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Fix bug sometimes skipping peptide bond when using bio ccd to infer bonds.
Test on PR activity
#254:
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#203
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1m 51s
ccd_peptide_bond
ccd_peptide_bond
1m 51s
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Fix bug sometimes skipping peptide bond when using bio ccd to infer bonds.
Test on PR activity
#253:
Pull request
#203
opened by
mtessmer
4m 45s
ccd_peptide_bond
ccd_peptide_bond
4m 45s
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Fix bug skipping ccd bonds when constructing molsys
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#252:
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#202
opened by
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4m 57s
add_ccd_bonds
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4m 57s
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Merge branch 'main' into docs
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#35:
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f6ed312
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Fix bug breaking docs build
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#34:
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docs
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Fix Example 14 link in README.md
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#250:
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#200
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4m 29s
fix_example_14_link
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4m 29s
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Update pages action
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#32:
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22s
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docs
22s
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chiLife 1.2
Test on PR activity
#249:
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#199
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4m 52s
chilife_1.2
chilife_1.2
4m 52s
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chiLife 1.2
Test on PR activity
#248:
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#199
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4m 11s
chilife_1.2
chilife_1.2
4m 11s
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chiLife 1.2
Test on PR activity
#247:
Pull request
#199
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4m 16s
chilife_1.2
chilife_1.2
4m 16s
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chiLife 1.2
Test on PR activity
#246:
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#199
synchronize by
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4m 34s
chilife_1.2
chilife_1.2
4m 34s
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chiLife 1.2
Test on PR activity
#245:
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#199
synchronize by
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5m 35s
chilife_1.2
chilife_1.2
5m 35s
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chiLife 1.2
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#244:
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#199
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4m 39s
chilife_1.2
chilife_1.2
4m 39s
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chiLife 1.2
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#243:
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4m 17s
chilife_1.2
chilife_1.2
4m 17s
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chiLife 1.2
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#242:
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4m 33s
chilife_1.2
chilife_1.2
4m 33s
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chiLife 1.2
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#241:
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4m 26s
chilife_1.2
chilife_1.2
4m 26s
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chiLife 1.2
Test on PR activity
#240:
Pull request
#199
opened by
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4m 14s
chilife_1.2
chilife_1.2
4m 14s
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Add point keyword to MolSys object for selection atoms neara point in space
Test on PR activity
#239:
Pull request
#198
opened by
mtessmer
5m 55s
molsys_point
molsys_point
5m 55s
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