Commit graph

96 commits

Author SHA1 Message Date
45889990e7 saving work for the day 2020-04-11 19:00:39 +01:00
7d2241ad81 added lambda func to normalise duet and aff values 2020-04-11 18:52:57 +01:00
398eccd246 added script to format results 2020-04-10 19:32:47 +01:00
f5241048b4 saving work for today 2020-04-09 16:40:45 +01:00
0550cfe0e2 adding separae script for getting results for mcsm 2020-04-09 15:42:56 +01:00
7cee9b21e2 refactoring bash into python to run mcsm 2020-04-08 18:27:51 +01:00
7a8bbc6595 minor tweaks 2020-04-08 18:27:09 +01:00
fe3d431a3d combine df script with command line args and added method 2020-04-08 12:44:17 +01:00
c025a22343 correcting indendation 2020-04-08 12:43:37 +01:00
30aa64fd2b refactoring: added command line args to combine_dfs 2020-04-08 11:44:53 +01:00
49a38dd1ae saving work for today 2020-04-07 17:57:34 +01:00
569b7c6c7f adapted rd_df script to make it take command line args and define function 2020-04-07 17:42:59 +01:00
811027e34d tidy kd_df script 2020-04-07 17:42:06 +01:00
02488ea23e adapted kd calc script with command line args and made it into a function 2020-04-07 16:45:59 +01:00
6afe202931 kd script with command line args and as function 2020-04-07 16:39:50 +01:00
44577b4a0c updating kd script to take command line args 2020-04-07 16:13:54 +01:00
24c7ade7c4 renamed file for consistency 2020-04-07 16:04:01 +01:00
f690c75ca0 modified dssp_df to handle multiple chains 2020-04-07 16:02:19 +01:00
d161fcd0f3 added dssp.py that runs, processes and outputs csv 2020-04-07 15:08:18 +01:00
b0e56328ef adding settings params 2020-04-06 19:04:35 +01:00
cc9cdbcad5 refactoring code to make it take command line args 2020-04-06 19:03:41 +01:00
b5aa524914 logoplot from df and seqs with custom height 2020-03-29 17:11:17 +01:00
34a2057d29 added R header file to base dir to allow general access by R scripts 2020-03-28 17:56:39 +00:00
b1e4dcd376 tidied combining plot scripts 2020-03-28 17:54:45 +00:00
e7f2a3aada added mutate.py script for msa generation 2020-03-27 17:11:16 +00:00
ab541aa3de saving work for the day 2020-03-27 17:08:33 +00:00
d1da203df0 changed filename to the new combined output (mcsm+struct params) 2020-03-27 12:43:48 +00:00
82e96fcdba combining mcsm and struct params 2020-03-27 12:39:02 +00:00
afd6ca8881 tidy code and saving work for the day 2020-03-26 17:58:39 +00:00
69e2567ffc added script to combined dfs of structural params like kd, dssp & rd 2020-03-26 17:14:20 +00:00
c0bac6fd7b changed outcols in dssp and kd outputs 2020-03-26 17:12:59 +00:00
5bab99c15f added residue depth processing to generate df 2020-03-26 15:44:20 +00:00
0b7a938fbd tidy code and renamed kd.py to kd_df.py 2020-03-26 15:43:13 +00:00
4c2fa2b600 tidied and updated kd and dssp scripts & generated their respective outputs 2020-03-25 18:19:23 +00:00
87a847109a updated kd.py to relfect a merging col for combining num params later 2020-03-25 15:20:54 +00:00
de1822f491 output from comb script & electrostatic mut changes calculated 2020-03-25 13:42:18 +00:00
96ebb85069 updated combining df scripts for duet & lig 2020-03-24 18:28:52 +00:00
c184841951 minor changes to variable names in .R & .py 2020-03-24 10:36:51 +00:00
dd91692673 renamed files to make more generic 2020-03-23 18:13:02 +00:00
22a0d38563 renamed files to make more generic 2020-03-23 17:48:39 +00:00
d42e6fbdb3 fixed bugs and tidy code 2020-03-23 17:43:06 +00:00
b4dbad7e54 delete old file 2020-03-23 17:40:19 +00:00
b331227023 updated pnca_extraction and AF_OR calcs 2020-03-23 17:36:42 +00:00
eb021349fe bug fixes and massive clean up of data extraction script 2020-03-23 13:33:25 +00:00
8df0b7d920 saving from work 2020-02-27 15:16:20 +00:00
77cc5bf42c renamed file and updated logo plot code 2020-02-26 12:00:32 +00:00
95e8205189 added 2 logo plot scripts 2020-02-25 19:09:43 +00:00
f9837b474c updating mut_seq script 2020-02-25 18:13:18 +00:00
e9a95e9d3a hydrophobicity script 2020-02-25 10:42:58 +00:00
ed8fc4d488 remove old surface_res3.py 2020-02-20 12:23:56 +00:00