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Commits on Mar 11, 2024

• add more side chain option, switch H cap with CH2 cap (#37)

  daico007

  authored
  783baf3

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Commits on Oct 16, 2023

• Add more terminal groups (#36)

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  daico007

  authored
  81c9346

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Commits on Sep 27, 2023

• Consolidate pNBDAC (#35)

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  daico007

  authored
  1d66074

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Commits on Sep 22, 2023

• Fix a bug in Monolayer (#34)

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  daico007

  authored
  8a6b539

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Commits on Sep 14, 2023

• add ether nbdac (#33)

  daico007

  authored
  cbb04f9

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• Add new surfaces (#32)

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  daico007

  authored
  109a07d

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Commits on Sep 13, 2023

• Add utility and fix bug with dual_monoalyer (#31)

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  daico007

  authored
  c0e9e63

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Commits on Sep 6, 2023

• Adjustment in syntax (#30)

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  daico007

  authored
  508eee3

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Commits on Jul 25, 2023

• Maintenance (#29)

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  daico007

  authored
  bcd5d1c

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Commits on Jun 27, 2023

• add option to provide index list (#27)

  daico007

  authored
  d2b4941

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Commits on Jun 15, 2023

• add align option for pNBDAC (#26)

  daico007

  authored
  ea19d22

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Commits on Jun 13, 2023

• Add dimension for SilicaInterface class (#25)

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  daico007

  authored
  bc4c701

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Commits on Jun 2, 2023

• Add amino ethyl side chain (#24)

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  daico007

  authored
  8301750

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Commits on May 26, 2023

• quick bug fix

  daico007

  committed
  83ba6d3

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• change default val of silicon surface (#23)

  daico007

  authored
  f79cee2

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Commits on May 25, 2023

• udpate python version in CI (#21)

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  daico007

  authored
  96ef889

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• Modify Setup (#20)

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  daico007

  authored
  a403363

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Commits on Apr 25, 2023

• update syntax to work with mbuild 0.16.1 (#19)

  daico007

  authored
  4ea3b10

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Commits on Apr 24, 2023

• better set box of monolayer/solvated monolayer (#18)

  daico007

  authored
  4723876

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Commits on Oct 5, 2022

• Update the silane polymer class (#17)

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  daico007

  authored
  2ec1ede

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Commits on Jun 28, 2022

• add side_chains and terminal_groups for mNBDAC (#16)

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  daico007

  authored
  855ec9c

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Commits on Jun 15, 2022

• corrected imports (#15)

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  kierannp

  and

  nehilkieran@gmail.com

  authored
  2581147

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Commits on Jun 13, 2022

• Add pNBDAC (#11)

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  daico007

  authored
  4182d3d

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Commits on Jun 2, 2022

• Merge branch 'master' of https://github.com/daico007/surface_coatings

  daico007

  committed
  fde9086

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• Bug fix: removed obsolete reference

  daico007

  committed
  e8f7029

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• remove wrong silane initiator, using mbuild silane (#10)

  daico007

  authored
  6ba8d39

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Commits on Mar 10, 2022

• Add github action for testing (#3)

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  daico007

  authored
  13e2147

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Commits on Mar 9, 2022

• Add pmpc chains (#9)

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  daico007

  authored
  077d291

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Commits on Mar 8, 2022

• add shift options when building dual surface (#8)

  daico007

  authored
  76dbf47

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Commits on Mar 4, 2022

• Generate bonds with freud (#7)

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  daico007

  authored
  b66b876

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Commits on Nov 15, 2021

• add more conditions check when constructing dual monolayer

  daico007

  committed
  88e5427

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Commits on Oct 22, 2021

• update terminal_group molecule bank

  daico007

  committed
  c0d77b6

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• fix bug when accidentally turning compound to list

  daico007

  committed
  541a559

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Commits on Sep 30, 2021

• Create a surface with multiple different chains (#5)

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  CalCraven

  and

  daico007

  authored
  81fda7e

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Commits on Sep 27, 2021

• Add smooth silica surface (#4)

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  daico007

  authored
  dbe97e3

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