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Is it possible to obtain the interacting residues?
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1
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339
|
October 12, 2022
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About the config.txt for docking programs
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1
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474
|
May 20, 2022
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The failed ligands in VFVS between different clusters
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0
|
326
|
May 9, 2022
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Vfvs_pp_ranking_all.sh file missing
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2
|
447
|
April 9, 2022
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Ligands skipped seemingly at random
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6
|
449
|
February 28, 2022
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Vf_continue.all.sh failing
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5
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482
|
February 18, 2022
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Ln: failed to create symbolic link '../../workflow/ligand-collections/todo/todo.all.locked': File exists
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0
|
370
|
February 8, 2022
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Error on line 68
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8
|
648
|
January 4, 2022
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VFVS_GK Tutorial2 failing with the suggested settings
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1
|
418
|
October 14, 2021
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VFVS_GK running without results
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2
|
440
|
October 8, 2021
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|
Running VFVS/Vina on AWS Graviton (ARM processors)
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1
|
380
|
September 30, 2021
|
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Obtaining lowest binding affinity and extracting the residue
|
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3
|
395
|
August 26, 2021
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./vf_report.sh -c workflow ligand collections processing or not started
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2
|
412
|
August 5, 2021
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Easy way to add a ligand to your ligand-library?
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1
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343
|
July 26, 2021
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Implementing my own receptor using preconfigured example
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1
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358
|
July 25, 2021
|
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Complete and incomplete pp_ranking vs_report
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0
|
351
|
July 15, 2021
|
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I need optimized slurm template
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1
|
362
|
June 6, 2021
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Optimal parameters for workflow
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1
|
393
|
June 6, 2021
|
|
Setting and Running VFVS on AWS
|
|
1
|
451
|
April 23, 2020
|
|
What are the optimal parameters for the all.ctrl file in the O2(Orchestra2) cluster?
|
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4
|
440
|
March 23, 2021
|
|
VFVS for randomly selected ligands?
|
|
7
|
608
|
February 13, 2021
|
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Stopping the submitted jobs
|
|
3
|
408
|
February 11, 2021
|
|
The pre-configured todo list run but if replaced with new ligands it fails
|
|
7
|
547
|
January 12, 2021
|
|
Optimal high performance computing facility setup
|
|
6
|
527
|
January 12, 2021
|
|
Real Library Usage
|
|
4
|
674
|
January 6, 2021
|
|
Is it normal for flexible docking to take up a lot of inodes in /tmp?
|
|
3
|
509
|
December 16, 2020
|
|
Getting started: Google Cloud v. local cluster
|
|
8
|
820
|
December 2, 2020
|
|
VFVS Tutorial-1 failing after 1 min
|
|
2
|
480
|
November 16, 2020
|
|
Job is not failed, but the .err file of queue which is in the workflow output file had error message
|
|
2
|
337
|
August 30, 2020
|
|
Some errors occurred when operating the flexible docking
|
|
4
|
471
|
August 22, 2020
|