various
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parent
0284122ef2
commit
9aed99e805
6 changed files with 26 additions and 22 deletions
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@ -274,6 +274,8 @@ if (nrow(dd_lig) == table(str_df_plot_cols$pe_effect_outcome)[['DD_lig']]){
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}else{
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stop("Abort: DD affinity colour numbers mismtatch")
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}
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paste0(dd_lig_pos,chain_suffix)
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toString(paste0(dd_lig_pos,chain_suffix))
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# +ve Lig Aff
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ss_lig = str_df_plot_cols[str_df_plot_cols$pe_effect_outcome=="SS_lig",]
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@ -284,8 +286,8 @@ if (nrow(ss_lig) == table(str_df_plot_cols$pe_effect_outcome)[['SS_lig']]){
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stop("Abort: SS affinity colour numbers mismtatch")
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}
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#put in chimera cmd
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paste0(dd_lig_pos,chain_suffix)
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paste0(ss_lig_pos,chain_suffix)
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toString(paste0(ss_lig_pos,chain_suffix))
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}
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@ -310,8 +312,8 @@ if (nrow(ss_nca) == table(str_df_plot_cols$pe_effect_outcome)[['SS_nucleic_acid
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}
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#put in chimera cmd
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paste0(dd_nca_pos, chain_suffix)
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paste0(ss_nca_pos, chain_suffix)
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toString(paste0(dd_nca_pos, chain_suffix))
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toString(paste0(ss_nca_pos, chain_suffix))
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#=========================================================
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#------------------------
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@ -335,7 +337,7 @@ if (nrow(ss_stability) == table(str_df_plot_cols$pe_effect_outcome)[['SS_stabil
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#put in chimera cmd
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# stabiliting first as it has less numbers
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paste0(ss_stability_pos, chain_suffix)
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paste0(dd_stability_pos, chain_suffix)
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toString(paste0(dd_stability_pos, chain_suffix))
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toString(paste0(ss_stability_pos, chain_suffix))
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####################################################################
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