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Tag: electrostatics
6 items with this tag.
Apr 26, 2026
Phase 8h-lite #3 · Off-target selectivity charge proxy (inconclusive light)
strc
h01
off-target
selectivity
electrostatics
Apr 25, 2026
STRC h01 Phase 5k-WT Matched Ensemble APBS 2026-04-25
strc
h01
phase-proof
phase5
electrostatics
apbs
md
matched-ensemble
pharmacochaperone
specificity
Apr 24, 2026
STRC h01 Phase 4i APBS Pose-Transplant Rescore 2026-04-24
strc
h01
phase-proof
phase4
electrostatics
apbs
pose-rescore
pharmacochaperone
tier4
Apr 24, 2026
STRC h01 Phase 5j APBS WT vs Mutant Pocket Electrostatics 2026-04-24
strc
h01
phase-proof
phase5
electrostatics
apbs
poisson-boltzmann
pharmacochaperone
Apr 24, 2026
STRC h01 Phase 5k Ensemble APBS on Phase 5d Mutant MD 2026-04-24
strc
h01
phase-proof
phase5
electrostatics
apbs
md
pharmacochaperone
tier0
1-Coulomb
Apr 24, 2026
APBS
tool
electrostatics
poisson-boltzmann
apbs
pdb2pqr
strc