Amber Archive Mar 2006 by messages with attachments

289 messages: Starting Sun Mar 05 2006 - 06:10:11 PST, Ending Sun Apr 02 2006 - 06:10:17 PDT
This period: Most recent messages
sort by: [ thread ] [ author ] [ date ] [ subject ] [ attachment ]

AMBER: GAFF + AM1BCC & small-molecule aggregation Scott P Brown (Wed Mar 01 2006 - 12:00:33 PST)
1. bcl_adeno_stripwat_h.pdb (128640 bytes)
2. adeno_AC.mol2 (3478 bytes)
3. md.in (604 bytes)
AMBER: Steve Seibold (Mon Mar 13 2006 - 06:17:41 PST)
1. frcmod (62 bytes)
2. tp.pdb (1053 bytes)
3. tp.mol2 (1451 bytes)
AMBER: heating system snoze pa (Tue Mar 21 2006 - 13:58:25 PST)
1. fig1.png (200347 bytes)
2. fig2.png (248702 bytes)
AMBER: what is unit of the out put of mmpbsa caculation snowyowls (Thu Mar 23 2006 - 04:47:52 PST)
1. what_is_unit (1 bytes)
AMBER: Average pdb Claire Zerafa (Thu Mar 23 2006 - 13:17:33 PST)
1. BackGrnd.jpg (1431 bytes)
2. imstp_chubbi_en.gif (20284 bytes)
To dac --AMBER: anal: dihedral error 莉张 (Sun Mar 26 2006 - 22:43:22 PST)
1. complex.top.gz (356995 bytes)
AMBER: Simulating a periodic crystal Jiang Jianwen (Wed Mar 29 2006 - 07:01:26 PST)
1. periodic_box_for_DNA_crystal.htm (5053 bytes)
2. simulating_a_crystal_using_the_unit_cell_dac.htm (1898 bytes)
Re: AMBER: charge constraints in resp Kenley Barrett (Thu Mar 30 2006 - 11:46:49 PST)
1. MHaa_New.final.pdb (1444 bytes)
AMBER: LES error Claudia Steinert (Thu Mar 30 2006 - 23:59:36 PST)
1. crm_addles.in (478 bytes)
AMBER: Ptraj & pca Claire Zerafa (Fri Mar 31 2006 - 06:23:05 PST)
1. 3.gif (37694 bytes)
2. 0.gif (181 bytes)
3. imstp_heads_en.gif (18963 bytes)
AMBER: MMPBSA & PBCAL Rabal Gracia María Obdulia (Fri Mar 31 2006 - 07:37:57 PST)
1. cargas.crg (109079 bytes)
2. delphi.prm.0.0 (173 bytes)
3. radios.siz (109074 bytes)
4. snap_lig.delphilog.1.0.0 (9760 bytes)
5. snap_lig.pdb.1 (1822 bytes)