Amber Archive Dec 2004 by messages with attachments

Re: AMBER: FEP along a reaction coordinate in sander Masataka Nagaoka (Wed Dec 01 2004 - 04:05:01 PST)
1. JCP07972.pdf (414429 bytes)
2. CPL348350.pdf (171128 bytes)
Re: Re: AMBER: Why the surface calculations sometimes fail? hj zou (Wed Dec 08 2004 - 17:58:19 PST)
1. XXX_com.log (3863 bytes)
2. xxx_com.pdb.9 (283856 bytes)
Re: Re: Re: AMBER: Why the surface calculations sometimes fail? hj zou (Wed Dec 15 2004 - 20:12:59 PST)
1. all.tar.gz (577979 bytes)
Re: AMBER: entropy implementation in ptraj Raik Grünberg (Fri Dec 17 2004 - 06:44:13 PST)
1. ptraj_out (121582 bytes)
Re: AMBER: use leap to build top & crd files for a pdb file with crytalline water molecules Jianwen Jiang (Tue Dec 21 2004 - 14:30:47 PST)
1. 1AKI_wat.pdb (109470 bytes)
2. 1AKI_nowat.pdb (103074 bytes)
Re: AMBER: How is optimization done during energy minimization of the force field? myang (Fri Dec 31 2004 - 08:49:58 PST)
1. part (308 bytes)

Last message date: Fri Dec 31 2004 - 17:53:00 PST
Archived on: Wed Dec 25 2024 - 05:53:25 PST

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