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July 2017


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Fw: Heparin Amber parameters from online GLYCAM builder (1 message)
Residue on parm file from gag builder missing in GLYCAM_06j-1.prep (6 messages)
SO3 group bond type for GLYCAM in LAMMPS - reg. (7 messages)
TIP3P water model - lammps data file doesn't include angle information. (4 messages)
TIP3P water model - lammps data file doesn't include angleinformation. (1 message)
weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS) (6 messages)

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Fw: Heparin Amber parameters from online GLYCAM builder

Fw: Heparin Amber parameters from online GLYCAM builder

B. Lachele Foley <[log in to unmask]>

Thu, 13 Jul 2017 20:20:15 +0000

87 lines

New Thread

Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

Re: Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

Cesar Avila <[log in to unmask]>

Wed, 26 Jul 2017 19:26:01 -0300

419 lines

Re: Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

David Thieker <[log in to unmask]>

Wed, 26 Jul 2017 13:32:33 -0400

7495 lines

Re: Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

Cesar Avila <[log in to unmask]>

Wed, 26 Jul 2017 12:23:41 -0300

82 lines

Re: Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

David Thieker <[log in to unmask]>

Wed, 26 Jul 2017 10:26:11 -0400

111 lines

Re: Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

David Thieker <[log in to unmask]>

Tue, 25 Jul 2017 21:02:37 -0400

108 lines

Residue on parm file from gag builder missing in GLYCAM_06j-1.prep

Cesar Avila <[log in to unmask]>

Tue, 25 Jul 2017 18:35:42 -0400

28 lines

New Thread

SO3 group bond type for GLYCAM in LAMMPS - reg.

Re: SO3 group bond type for GLYCAM in LAMMPS - reg.

Naveen Kumar Vasudevan <[log in to unmask]>

Fri, 14 Jul 2017 08:48:20 -0400

271 lines

Re: SO3 group bond type for GLYCAM in LAMMPS - reg.

Lachele Foley <[log in to unmask]>

Fri, 14 Jul 2017 01:59:12 -0400

214 lines

Re: SO3 group bond type for GLYCAM in LAMMPS - reg.

Xiaocong Wang <[log in to unmask]>

Fri, 14 Jul 2017 05:22:23 +0000

187 lines

Re: SO3 group bond type for GLYCAM in LAMMPS - reg.

Naveen Kumar Vasudevan <[log in to unmask]>

Thu, 13 Jul 2017 15:34:43 -0400

17 lines

Re: SO3 group bond type for GLYCAM in LAMMPS - reg.

Lachele Foley <[log in to unmask]>

Thu, 13 Jul 2017 15:22:54 -0400

131 lines

SO3 group bond type for GLYCAM in LAMMPS - reg.

Naveen Kumar Vasudevan <[log in to unmask]>

Wed, 12 Jul 2017 17:14:29 -0400

37 lines

SO3 group bond type for GLYCAM in LAMMPS - reg.

Naveen Kumar Vasudevan <[log in to unmask]>

Wed, 12 Jul 2017 16:32:31 -0400

112 lines

New Thread

TIP3P water model - lammps data file doesn't include angle information.

Re: TIP3P water model - lammps data file doesn't include angle information.

Lachele Foley <[log in to unmask]>

Fri, 14 Jul 2017 02:00:01 -0400

48 lines

Re: TIP3P water model - lammps data file doesn't include angle information.

Naveen Kumar Vasudevan <[log in to unmask]>

Fri, 14 Jul 2017 00:30:05 -0400

12 lines

Re: TIP3P water model - lammps data file doesn't include angle information.

Oliver Grant <[log in to unmask]>

Fri, 14 Jul 2017 06:28:35 +0200

64 lines

TIP3P water model - lammps data file doesn't include angle information.

Naveen Kumar Vasudevan <[log in to unmask]>

Thu, 13 Jul 2017 23:02:31 -0400

24 lines

New Thread

TIP3P water model - lammps data file doesn't include angleinformation.

Re: TIP3P water model - lammps data file doesn't include angleinformation.

Naveen Kumar Vasudevan <[log in to unmask]>

Fri, 14 Jul 2017 08:45:32 -0400

102 lines

New Thread

weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Re: weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Naveen Kumar Vasudevan <[log in to unmask]>

Fri, 28 Jul 2017 01:58:45 -0400

426 lines

Re: weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Lachele Foley <[log in to unmask]>

Fri, 28 Jul 2017 01:56:19 -0400

408 lines

Re: weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Naveen Kumar Vasudevan <[log in to unmask]>

Thu, 27 Jul 2017 23:13:25 -0400

359 lines

Re: weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Lachele Foley <[log in to unmask]>

Thu, 27 Jul 2017 09:47:30 -0400

129 lines

Re: weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Lachele Foley <[log in to unmask]>

Thu, 27 Jul 2017 08:31:54 -0400

100 lines

weighing factor for 1-2,1-3,1-4 interactions - reg. (LAMMPS)

Naveen Kumar Vasudevan <[log in to unmask]>

Wed, 26 Jul 2017 13:52:42 -0400

26 lines

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