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Refactor lj parameters testsuite #65: Pull request #27 opened by pm-blanco
March 19, 2024 16:34 7m 58s refactor-lj-parameters
refactor-lj-parameters
March 19, 2024 16:34 7m 58s
fix path issues testsuite #64: Commit 53fdc13 pushed by pm-blanco
March 19, 2024 16:21 10m 38s refactor-lj-parameters
refactor-lj-parameters
March 19, 2024 16:21 10m 38s
replace diameter for sigma, set default of cutoff to 2**(1/6) reduced… testsuite #63: Commit e215a7a pushed by pm-blanco
March 19, 2024 13:59 8m 58s refactor-lj-parameters
refactor-lj-parameters
March 19, 2024 13:59 8m 58s
replace diameter for sigma testsuite #62: Commit 61afdee pushed by pm-blanco
March 18, 2024 18:40 2m 44s refactor-lj-parameters
refactor-lj-parameters
March 18, 2024 18:40 2m 44s
Add unit test for LJ setup to CI testsuite #61: Commit c49eb2c pushed by pm-blanco
March 18, 2024 18:33 2m 5s refactor-lj-parameters
refactor-lj-parameters
March 18, 2024 18:33 2m 5s
fix issues with units and bug with sigma=0 testsuite #60: Commit bcc4956 pushed by pm-blanco
March 18, 2024 14:36 1m 18s refactor-lj-parameters
refactor-lj-parameters
March 18, 2024 14:36 1m 18s
refactor define_particle and setup_lj(); add CI test for LJ setup testsuite #59: Commit 2c2c602 pushed by pm-blanco
March 18, 2024 13:25 3m 28s refactor-lj-parameters
refactor-lj-parameters
March 18, 2024 13:25 3m 28s
Fixing perpendicular vector testsuite #58: Pull request #26 synchronize by pm-blanco
March 14, 2024 14:48 7m 37s mariusaarsten:fixing_perpendicular_vector
mariusaarsten:fixing_perpendicular_vector
March 14, 2024 14:48 7m 37s
Fixing perpendicular vector testsuite #57: Pull request #26 synchronize by pm-blanco
March 14, 2024 14:46 7m 58s mariusaarsten:fixing_perpendicular_vector
mariusaarsten:fixing_perpendicular_vector
March 14, 2024 14:46 7m 58s
added value error if pka not provided for acidic or basic particles testsuite #54: Pull request #24 synchronize by pm-blanco
March 13, 2024 12:29 8m 3s mariusaarsten:fixing_set_particle_acidity
mariusaarsten:fixing_set_particle_acidity
March 13, 2024 12:29 8m 3s
added value error if pka not provided for acidic or basic particles testsuite #53: Pull request #24 opened by mariusaarsten
March 13, 2024 11:13 3m 34s mariusaarsten:fixing_set_particle_acidity
mariusaarsten:fixing_set_particle_acidity
March 13, 2024 11:13 3m 34s
deploy documentation deploy documentation #2: completed by pm-blanco
March 12, 2024 18:18 20s
March 12, 2024 18:18 20s
Merge pull request #23 from jngrad/deploy-pages testsuite #52: Commit fd8773e pushed by pm-blanco
March 12, 2024 18:08 9m 57s main
main
March 12, 2024 18:08 9m 57s
Build and deploy documentation with CI/CD pipeline testsuite #51: Pull request #23 opened by jngrad
March 12, 2024 14:57 9m 14s jngrad:deploy-pages
jngrad:deploy-pages
March 12, 2024 14:57 9m 14s
test deploy documentation #1: Commit 5c8a74e pushed by jngrad
March 12, 2024 14:13 2s test_deployment_via_pr
test_deployment_via_pr
March 12, 2024 14:13 2s
21 make calculate hh donnan independent of espresso testsuite #50: Pull request #22 opened by davidbbeyer
March 12, 2024 10:35 9m 17s 21-make-calculate_hh_donnan-independent-of-espresso
21-make-calculate_hh_donnan-independent-of-espresso
March 12, 2024 10:35 9m 17s
Adapted calculate_HH_Donnan testsuite #49: Commit c983344 pushed by davidbbeyer
March 12, 2024 10:31 8m 2s 21-make-calculate_hh_donnan-independent-of-espresso
21-make-calculate_hh_donnan-independent-of-espresso
March 12, 2024 10:31 8m 2s
Remove redundant sample script for G-RxMC testsuite #48: Commit 776b0ae pushed by davidbbeyer
March 12, 2024 10:11 7m 44s 21-make-calculate_hh_donnan-independent-of-espresso
21-make-calculate_hh_donnan-independent-of-espresso
March 12, 2024 10:11 7m 44s
Merge pull request #14 from pm-blanco/33-create-folder-paper testsuite #47: Commit cfc25cc pushed by davidbbeyer
March 12, 2024 08:46 9m 42s 21-make-calculate_hh_donnan-independent-of-espresso
21-make-calculate_hh_donnan-independent-of-espresso
March 12, 2024 08:46 9m 42s
Merge pull request #14 from pm-blanco/33-create-folder-paper testsuite #46: Commit cfc25cc pushed by pm-blanco
March 8, 2024 18:50 7m 53s main
main
March 8, 2024 18:50 7m 53s
Add CI for peptides and clean-up folder structure testsuite #45: Pull request #14 synchronize by jngrad
March 8, 2024 17:27 7m 31s 33-create-folder-paper
33-create-folder-paper
March 8, 2024 17:27 7m 31s
Improve testsuite testsuite #44: Commit b27f583 pushed by jngrad
March 8, 2024 17:27 7m 34s 33-create-folder-paper
33-create-folder-paper
March 8, 2024 17:27 7m 34s
added functions to convert format testsuite #43: Commit 7ba16c9 pushed by paobtorres
March 8, 2024 14:07 1m 53s origin/30-improve-read-write-functions
origin/30-improve-read-write-functions
March 8, 2024 14:07 1m 53s
changes on create variable testsuite #42: Commit 19546e7 pushed by paobtorres
March 8, 2024 13:57 1m 10s origin/30-improve-read-write-functions
origin/30-improve-read-write-functions
March 8, 2024 13:57 1m 10s
added parameter to setup_df testsuite #41: Commit 249da23 pushed by paobtorres
March 8, 2024 13:40 3m 57s origin/30-improve-read-write-functions
origin/30-improve-read-write-functions
March 8, 2024 13:40 3m 57s
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