Quantum Pharmaceuticals » polar liquid http://q-pharm.com The drug discovery company Thu, 05 Aug 2010 15:05:38 +0000 en hourly 1 http://wordpress.org/?v=3.0.1 Effects of the surface density on the stability of surface electrostatics models http://q-pharm.com/2010/05/effects-of-the-surface-density-on-the-stability-of-surface-electrostatics-models/ http://q-pharm.com/2010/05/effects-of-the-surface-density-on-the-stability-of-surface-electrostatics-models/#comments Thu, 20 May 2010 05:57:17 +0000 Peter Fedichev, Quantum CTO http://q-pharm.com/?p=236
  • O(N) Surface Charges Generalized Born calculation demonstration
  • FFT acceleration demonstration for (surface)GB methods
  • Protein solvation energies and GB surface charges: perfect match!
  • Surface GB models: the ultimate test
  • Water polarization charges in Generalized Born models.
    • Related posts brought to you by Yet Another Related Posts Plugin.]]>     http://q-pharm.com/2010/05/effects-of-the-surface-density-on-the-stability-of-surface-electrostatics-models/feed/ 1     Water molecules alignments on a hydrophobic surface – I http://q-pharm.com/2010/04/water-molecules-alignments-on-a-hydrophobic-surface-i/ http://q-pharm.com/2010/04/water-molecules-alignments-on-a-hydrophobic-surface-i/#comments Sun, 11 Apr 2010 19:45:54 +0000 Peter Fedichev, Quantum CTO http://q-pharm.com/?p=201
  • Water polarization and density profiles at a gas-liquid interface
  • Molecular polarization on a polar liquid interface: the structure of a water surface
  • Three great ways to calculate Born radii beyond the Coulomb Field Approximation
  • The nature of percolation phase transition in films of hydration water around immersed bodies.
  • Spontaneous polarization of a polar liquid next to nano-scale impurities
    • Related posts brought to you by Yet Another Related Posts Plugin.]]>     http://q-pharm.com/2010/04/water-molecules-alignments-on-a-hydrophobic-surface-i/feed/ 1     Water polarization and density profiles at a gas-liquid interface http://q-pharm.com/2010/03/water-polarization-and-density-profiles-at-a-gas-liquid-interface/ http://q-pharm.com/2010/03/water-polarization-and-density-profiles-at-a-gas-liquid-interface/#comments Thu, 25 Mar 2010 06:13:58 +0000 Peter Fedichev, Quantum CTO http://q-pharm.com/?p=195
  • Molecular polarization on a polar liquid interface: the structure of a water surface
  • Ferro-electric phase transition in a polar liquid and the nature of lambda-transition in supercooled water
  • Ferro-electric phase transition in a polar liquid and the nature of \lambda-transition in supercooled water
  • Water molecules alignments on a hydrophobic surface – I
  • Spontaneous polarization of a polar liquid next to nano-scale impurities
    • Related posts brought to you by Yet Another Related Posts Plugin.]]>     http://q-pharm.com/2010/03/water-polarization-and-density-profiles-at-a-gas-liquid-interface/feed/ 1     Ferro-electric phase transition in a polar liquid and the nature of \lambda-transition in supercooled water http://q-pharm.com/2009/12/ferro-electric-phase-transition-in-a-polar-liquid-and-the-nature-of-lambda-transition-in-supercooled-water-2/ http://q-pharm.com/2009/12/ferro-electric-phase-transition-in-a-polar-liquid-and-the-nature-of-lambda-transition-in-supercooled-water-2/#comments Sun, 20 Dec 2009 11:20:38 +0000 Peter Fedichev, Quantum CTO http://q-pharm.com/2009/12/ferro-electric-phase-transition-in-a-polar-liquid-and-the-nature-of-lambda-transition-in-supercooled-water-2/
  • Ferro-electric phase transition in a polar liquid and the nature of lambda-transition in supercooled water
  • The nature of percolation phase transition in films of hydration water around immersed bodies.
  • Phospholipid membranes repulsion at nm-distances explained within a continuous water model
  • Spontaneous polarization of a polar liquid next to nano-scale impurities
  • Water polarization and density profiles at a gas-liquid interface
    • Related posts brought to you by Yet Another Related Posts Plugin.]]>     http://q-pharm.com/2009/12/ferro-electric-phase-transition-in-a-polar-liquid-and-the-nature-of-lambda-transition-in-supercooled-water-2/feed/ 1     Phospholipid membranes repulsion at nm-distances explained within a continuous water model http://q-pharm.com/2009/12/phospholipid-membranes-repulsion-at-nm-distances-explained-within-a-continuous-water-model/ http://q-pharm.com/2009/12/phospholipid-membranes-repulsion-at-nm-distances-explained-within-a-continuous-water-model/#comments Mon, 14 Dec 2009 12:59:49 +0000 Peter Fedichev, Quantum CTO http://q-pharm.com/?p=167
  • The nature of phospholipid membranes repulsion at nm-distances
  • Ferro-electric phase transition in a polar liquid and the nature of \lambda-transition in supercooled water
  • Ferro-electric phase transition in a polar liquid and the nature of lambda-transition in supercooled water
  • Spontaneous polarization of a polar liquid next to nano-scale impurities
  • O(N) continuous electrostatics solvation energies calculation method for biomolecules simulations
    • Related posts brought to you by Yet Another Related Posts Plugin.]]>     http://q-pharm.com/2009/12/phospholipid-membranes-repulsion-at-nm-distances-explained-within-a-continuous-water-model/feed/ 0