- Aug 18, 2024
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Katarzyna Zator authored
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- Aug 12, 2024
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Katarzyna Zator authored
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- Aug 05, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Jul 30, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
- /AIP_interaction_map/tests/test_files/AB/A/compA.pdb - /AIP_interaction_map/tests/test_files/AB/A/compA_pre_compA.pdb - /AIP_interaction_map/tests/test_files/AB/A/combined.pdb - /AIP_interaction_map/tests/test_files/AB/A/correct_combined.pdb
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Jun 18, 2024
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Katarzyna Zator authored
- /AIP_interaction_map/tests/test_files/4llx/4llx_script - /AIP_interaction_map/tests/test_files/new_jmol_script
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Jun 14, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Jun 12, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Mar 15, 2024
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Katarzyna Zator authored
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- Mar 08, 2024
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Katarzyna Zator authored
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- Mar 07, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Feb 29, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Feb 28, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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- Feb 07, 2024
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Katarzyna Zator authored
many small changes: update vis colour, add all solvent as read in from file in data, updated sasa.ccp/py to read in sphpts - though hacky for now, updated script to produce only key variables in output table
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- Jan 18, 2024
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Katarzyna Zator authored
introduced RR H bond exclusion, SASA calculation, and exclusion for solvent contact of atoms - all AIPs for now
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Katarzyna Zator authored
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- Jan 17, 2024
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Katarzyna Zator authored
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- Jan 16, 2024
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Katarzyna Zator authored
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Katarzyna Zator authored
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Katarzyna Zator authored
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