Software Downloads:
- Qnifft: Software for macromolecular electrostatics.
Supported in part by NSF grant MCB02-35440
- Bqequil_pdb: Software for partial charge assignment.
Supported in part by NSF grant MCB02-35440 Yang Q, Sharp
KA. Atomic charge parameters for the finite difference
Poisson-Boltzmann method using electronegativity neutralization.
J Chem Theory Comp 2006;2:1152 - 1167
- Travel Depth: Software for determining the depth of every
part of a molecular surface. Supported in part by NSF
grant MCB02-35440 Coleman, R. G, Sharp K. A. Coleman, R.
G.; Sharp, K. A. J. Mol. Biol 2006, In Press.
- Surfmap: Software for mapping protein surfaces to a
sphere. Supported in part by NSF grant MCB02-35440
Rahi SJ, Sharp KA. Mapping complication surfaces to a sphere.
International Journal of Computational Geometry and Applications
2006
- Surfcv: Software for calculating solvent accessible area of
molecules
- Electrostatics presentation
Servers:
- Bqequil_pdb: Software to assign partial charges to protein/cofactors etc.
Supported in part by NSF grant MCB02-35440
- Software to produce geometrically and sterically correct conformational variants
of a protein using the elastic network (Tirion model)
Supported in part by NSF grant MCB02-35440
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