- 09 Aug, 2023 4 commits
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Mustafa Tekpinar authored
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Mustafa Tekpinar authored
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Mustafa Tekpinar authored
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Mustafa Tekpinar authored
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- 01 Aug, 2023 1 commit
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Mustafa Tekpinar authored
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- 31 Jul, 2023 2 commits
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If a pdbfile is provided, normweightmode becomes sstjetormaxtwocomponent automatically. Else, it is tjet.
Mustafa Tekpinar authored -
Mustafa Tekpinar authored
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- 20 Jul, 2023 1 commit
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Mustafa Tekpinar authored
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- 07 Jul, 2023 1 commit
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Mustafa Tekpinar authored
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- 22 Jun, 2023 2 commits
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Mustafa Tekpinar authored
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Mustafa Tekpinar authored
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- 21 Jun, 2023 1 commit
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Mustafa Tekpinar authored
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- 16 Jun, 2023 1 commit
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There is not any algorithmic changes in this version. However, I made the following changes to make Python and Docker installations better: 1-I changed base ubuntu from 20.04 to 22.04. 2-dssp 4.0 in Ubuntu 22.04 have a shitty requirement of CRYST record in the pdb file. Therefore, I manually installed dssp 3. 3-I needed at least Python 3.9 for importlib.resources and I made the required changes both in setup.py and Dockerfile for that.
Mustafa Tekpinar authored
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- 13 Jun, 2023 1 commit
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Mustafa Tekpinar authored
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- 11 Jun, 2023 1 commit
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Mustafa Tekpinar authored
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- 08 Jun, 2023 1 commit
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Since esgemme calls two R scripts, namely pred.R and computePred.R, to do the calculations, I added them as package resource. They are copied to the folder where ESGEMME is initiated. I'm trying to remove this kind of path dependencies to make the program automatically installable and portable.
Mustafa Tekpinar authored
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- 07 Jun, 2023 1 commit
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Mustafa Tekpinar authored
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- 06 Jun, 2023 2 commits
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Mustafa Tekpinar authored
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I adapted my code and Dockerfile to accomodate pip installable version of ESGEMME.
Mustafa Tekpinar authored
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- 04 Jun, 2023 1 commit
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Mustafa Tekpinar authored
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- 02 Jun, 2023 1 commit
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When a protein is bigger than 3276 aa's, matplotlib can not plot it due to 2^16 horizontal pixel size limit. I changed plotGEMMEmatrix function and the way I call it to solve this problem. Now, the program will divide big proteins into 500 aa chuncks and plot it in that way.
Mustafa Tekpinar authored
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- 01 Jun, 2023 1 commit
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--verbose option controls if epistatic and independent results files will be written or not. It is False by default and therefore, the files are not written.
Mustafa Tekpinar authored
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- 30 May, 2023 1 commit
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Mustafa Tekpinar authored
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- 27 May, 2023 2 commits
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Mustafa Tekpinar authored
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Mustafa Tekpinar authored
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- 26 May, 2023 1 commit
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Mustafa Tekpinar authored
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- 25 May, 2023 1 commit
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Mustafa Tekpinar authored
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- 24 May, 2023 1 commit
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Mustafa Tekpinar authored
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- 05 May, 2023 1 commit
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Mustafa Tekpinar authored
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- 15 Apr, 2023 1 commit
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Mustafa Tekpinar authored
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- 14 Apr, 2023 1 commit
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Mustafa Tekpinar authored
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- 06 Apr, 2023 1 commit
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Mustafa Tekpinar authored
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- 03 Apr, 2023 1 commit
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Mustafa Tekpinar authored
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- 31 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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- 30 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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- 29 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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- 28 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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- 20 Mar, 2023 1 commit
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Convert trace->tjet, maxhalftracepchalftracecvhalfcvpc->max and ssjetormax->sstjetormax in ESGEMME.
Mustafa Tekpinar authored
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- 16 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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- 15 Mar, 2023 1 commit
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Mustafa Tekpinar authored
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