Messages by Thread
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[Xplor-nih] structure refinement in explicit solvent like water
Martin Allan
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[Xplor-nih] implementing the two types of parallelism
RMB Hoffman
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[Xplor-nih] Angles as restraints
R.M. van der Werf
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[Xplor-nih] RDC back calculation
Shi,Lei
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Re: [Xplor-nih] Xplor-nih Digest, Vol 53, Issue 7
Shi,Lei
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[Xplor-nih] VMD-XPLOR
Marcela Madrid
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[Xplor-nih] annealing with ambiguous restraints
Leao Lagarto
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[Xplor-nih] A basic query regarding RDC calculation.
Arun Prasad
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[Xplor-nih] Query regarding Molecular principal axis.
Arun Prasad
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[Xplor-nih] HBDB and segments
Ioannis Vakonakis
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[Xplor-nih] RNA-DNA Hybrid
brinson
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[Xplor-nih] Fe vdW radius
Dan Fishelovitch
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[Xplor-nih] Query regarding RDC potential functions
Arun Prasad
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[Xplor-nih] Distance geometry output
KWAN,JASON C
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[Xplor-nih] [Fwd: Re: nmrDraw peak file format]
Gary S. Thompson
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Re: [Xplor-nih] Xplor-nih Digest, Vol 52, Issue 12
Gary S. Thompson
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[Xplor-nih] error message
Marco Roeben
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[Xplor-nih] Ligand docking with Hbuild
Clemens C Heikaus
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[Xplor-nih] average structure
Xiaohu Peng
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[Xplor-nih] how to get shift lists
Gary S. Thompson
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[Xplor-nih] marvin
gary thompson
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[Xplor-nih] XPLOR covar analysis
Dan Fishelovitch
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[Xplor-nih] How do I interpret the calculation result
Xiaohu Peng
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[Xplor-nih] comprehension problem in anneal.py source code
Marco Roeben
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[Xplor-nih] [email protected]
Shi,Lei
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[Xplor-nih] how to use both cpu on a dual core processor
Marco Roeben
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[Xplor-nih] "good" strucutre?
Xiaohu Peng
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[Xplor-nih] pdb2psf for non-protein / non-dna
Feldkamp, Joe
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[Xplor-nih] vdw violations
Lei Shi
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Re: [Xplor-nih] Xplor-nih Digest, Vol 51, Issue 10
Gary S. Thompson
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[Xplor-nih] sge
Gary S. Thompson
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[Xplor-nih] marvin example scripts
Gary S. Thompson
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[Xplor-nih] help with anneal.py
svasudev
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Re: [Xplor-nih] Help: VDW violations in Xplor-nih
Lei Shi
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[Xplor-nih] adding ions to my structure -- three questions
RMB Hoffman
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[Xplor-nih] Torsion angle dynamics
Lei Shi
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[Xplor-nih] Problems with maintaining ligand planarity
RMB Hoffman
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[Xplor-nih] NAG in protein models
Ioannis Vakonakis
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Re: [Xplor-nih] Xplor-nih Digest, Vol 51, Issue 1
Lei Shi
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[Xplor-nih] Ramachandran plot
kunal bakshi
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[Xplor-nih] Small molecules with XPLOR-NIH
Tom Anderson
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[Xplor-nih] how to build a symmetric oligomer
Lei Shi
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[Xplor-nih] Left handed residue in Ramachandran
Shi,Lei
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[Xplor-nih] Metal-cluster
Hongyan Li
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[Xplor-nih] alignment tensor
Irina Nesmelova
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[Xplor-nih] RedHat 9.0
Michael Hodsdon
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[Xplor-nih] [email protected]: Re: anneal.py script
Charles
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[Xplor-nih] installation on RedHat 9
Michael Hodsdon
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[Xplor-nih] nmrstar to xplornih
Jeff Ellena
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[Xplor-nih] [email protected]: Re: update on NOE problem
Charles
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[Xplor-nih] Installation errors on apple G5
svasudev
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[Xplor-nih] update on NOE problem
Michael Hodsdon
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Re: [Xplor-nih] Xplor-nih Digest, Vol 49, Issue 9
R.M. van der Werf
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[Xplor-nih] xplor-NIH refine.py
Hongyan Li
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[Xplor-nih] request for some help
Michael Hodsdon
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[Xplor-nih] Torsion potential in other solvents
Léon Salgado
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[Xplor-nih] xplor-nih trajectories
David A. Horita
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[Xplor-nih] Python output
wzhang14
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[Xplor-nih] problem with refine.py
Hongyan Li
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[Xplor-nih] refine.py and anneal.py etc.
Hongyan Li
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[Xplor-nih] Metal cluster
Hongyan Li
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[Xplor-nih] installtion OS (linux)
김소연
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[Xplor-nih] xplor backward compatibility
Gregoire Masliah
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[Xplor-nih] How can I obtain a theoretical NOESY
J.I. Miranda
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[Xplor-nih] Nature Network Biomolecular NMR
Michael Durney
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[Xplor-nih] Problems constraining a guanine residue to syn conformation
yu269821
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[Xplor-nih] How can I obtain a theoretical NOESY
J.I. Miranda
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[Xplor-nih] Max No of noe restraints
Franz Hagn
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[Xplor-nih] Topology for nucleic acids
R.M. van der Werf
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[Xplor-nih] Query: Problem with PSF generation from PDB file!
Chitra Narayanan
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[Xplor-nih] reading data from nmrpipe and talos
Jeff Ellena
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[Xplor-nih] PDB to PSF
R.M. van der Werf
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[Xplor-nih] weights for energy terms
Tomasz Cierpicki
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[Xplor-nih] problems xplor-NIH on clustercomputer
R.M. van der Werf
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[Xplor-nih] rdcs, shake
Barbara Richter
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[Xplor-nih] seq2psf and pdb2psf
Blanton Tolbert
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[Xplor-nih] RDC-refinement with floating alignment tensor
R.M. van der Werf
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[Xplor-nih] How do I know when AtomSel (doesn't) work?
RMB Hoffman
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[Xplor-nih] volume peak calibration
gil sal
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[Xplor-nih] RNA refinement
Blanton Tolbert
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[Xplor-nih] RDC Rfactor question
Eugene DeRose
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[Xplor-nih] C terminal Amide
Sebastiano Collino
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[Xplor-nih] select a part of a molecule in the tbl file
spitaleri.andrea