Commit graph

37 commits

Author SHA1 Message Date
2ca5aea897 refactoring: added command line args to combine_dfs 2020-04-08 11:44:53 +01:00
ded7307c22 kd script with command line args and as function 2020-04-07 16:39:50 +01:00
129808d4a5 updating kd script to take command line args 2020-04-07 16:13:54 +01:00
91068f5bd1 modified dssp_df to handle multiple chains 2020-04-07 16:02:19 +01:00
3905a81c38 refactoring code to make it take command line args 2020-04-06 19:03:41 +01:00
0191ee3493 logoplot from df and seqs with custom height 2020-03-29 17:11:17 +01:00
745dd343fd tidied combining plot scripts 2020-03-28 17:54:45 +00:00
4569e704c1 added mutate.py script for msa generation 2020-03-27 17:11:16 +00:00
e598f7d5dd combining mcsm and struct params 2020-03-27 12:39:02 +00:00
0eaff73114 tidy code and saving work for the day 2020-03-26 17:58:39 +00:00
f0becbe386 added script to combined dfs of structural params like kd, dssp & rd 2020-03-26 17:14:20 +00:00
51a9d814c2 changed outcols in dssp and kd outputs 2020-03-26 17:12:59 +00:00
dd2e2d03eb added residue depth processing to generate df 2020-03-26 15:44:20 +00:00
a074d29f6e tidy code and renamed kd.py to kd_df.py 2020-03-26 15:43:13 +00:00
73e0029b65 tidied and updated kd and dssp scripts & generated their respective outputs 2020-03-25 18:19:23 +00:00
37e1d43b76 updated kd.py to relfect a merging col for combining num params later 2020-03-25 15:20:54 +00:00
d44ab57f5a output from comb script & electrostatic mut changes calculated 2020-03-25 13:42:18 +00:00
954eb88c45 updated combining df scripts for duet & lig 2020-03-24 18:28:52 +00:00
d81be80305 minor changes to variable names in .R & .py 2020-03-24 10:36:51 +00:00
0001c727e0 renamed files to make more generic 2020-03-23 18:13:02 +00:00
d29b81a686 renamed files to make more generic 2020-03-23 17:48:39 +00:00
8c7efcb276 fixed bugs and tidy code 2020-03-23 17:43:06 +00:00
5adef195e0 delete old file 2020-03-23 17:40:19 +00:00
f686563c98 updated pnca_extraction and AF_OR calcs 2020-03-23 17:36:42 +00:00
53d19d5dd8 bug fixes and massive clean up of data extraction script 2020-03-23 13:33:25 +00:00
a5356cf88b saving from work 2020-02-27 15:16:20 +00:00
2805fdda40 hydrophobicity script 2020-02-25 10:42:58 +00:00
2ed0df41e2 remove old surface_res3.py 2020-02-20 12:23:56 +00:00
26e4652d63 fixup 2020-02-20 10:41:49 +00:00
ec25e9fd2d adding scripts for struct params 2020-02-16 15:14:36 +00:00
31dd74d5ac remove __pycache__, update .gitignore 2020-02-16 15:08:45 +00:00
f22f674097 added script to calculate electrostatic changes of mutations 2020-02-11 15:03:21 +00:00
56e7a96b00 updated ref dict to inc aa_calcprop 2020-02-11 15:02:32 +00:00
c10d54f104 tidy script for data extraction 2020-01-28 11:53:10 +00:00
a3c564790a saving data_extraction from home 2020-01-28 10:10:16 +00:00
0ebd8a6d4b saving previous work from home pc 2020-01-23 09:31:35 +00:00
bccfe68192 import commit 2020-01-08 16:15:33 +00:00