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added check for active site mut count

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Tanushree Tunstall 2020-09-11 17:41:40 +01:00
parent 0665bc80a9
commit 4e2bf1496a
1 changed files with 8 additions and 1 deletions
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9
scripts/plotting/extreme_muts.R
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@ -108,7 +108,7 @@ close_s_lig = df_s_lig[order(df_s_lig$ligand_distance, df_s_lig$ligand_affinity_
#=============== #===============
# foldx # foldx
#================ #===============
df_d_foldx = df[df$foldx_outcome == "Destabilising",] df_d_foldx = df[df$foldx_outcome == "Destabilising",]
hd_foldx = df_d_foldx[df_d_foldx$ddg == max(df_d_foldx$ddg), ] hd_foldx = df_d_foldx[df_d_foldx$ddg == max(df_d_foldx$ddg), ]
hd_foldx hd_foldx
@ -117,3 +117,10 @@ hd_foldx
df_s_foldx = df[df$foldx_outcome == "Stabilising",] df_s_foldx = df[df$foldx_outcome == "Stabilising",]
hs_foldx = df_s_foldx[df_s_foldx$ddg == min(df_s_foldx$ddg), ] hs_foldx = df_s_foldx[df_s_foldx$ddg == min(df_s_foldx$ddg), ]
hs_foldx hs_foldx
#===============
# active site muts
#===============
aa_muts = merged_df3[merged_df3$ligand_distance<5,]