Quantum Pharmaceuticals
Quantum Pharmaceuticals is a technology based drug discovery company. We develop a unique computational drug discovery platform (QUANTUM), provide drug discovery services, and pursue our own in-house drug discovery projects searching for novel compounds with anti-bacterial, anti-viral and anti-cancer efficacy.
Quantum@linkedin.com
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Categories
- absorbtion (3)
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Recent comments
- Talk@MIPT (in Russian) on Video recorded from "Water as a ferroelectric…" presentation at MIPT, November 5th, 2008
- FFT acceleration demonstration for (surface)GB methods on Water polarization charges in Generalized Born models.
- FFT acceleration demonstration for (surface)GB methods on O(N) Surface Charges Generalized Born calculation demonstration
- FFT acceleration demonstration for (surface)GB methods on O(N) SCGB solvation models: first “blood”
- FFT acceleration demonstration for (surface)GB methods on How to use Born surface charges to calculate solvation energy?
Archive for August, 2008
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Quantum LogP module (part of q-Mol package) has been benchmarked by vcclab.org
Posted on August 20, 2008 | View CommentsQuantum LogP module (part of q-Mol package) has been reviewed by R. Mannhold et al. (vcclab.org) in “Calculation of Molecular Lipophilicity: State-of-the-Art and Comparison of Log P Methods on More Than 96,000 Compounds”. From the manuscript: “Quantum LogP, developed by Quantum Pharmaceuticals, uses another quantum-chemical... -
Ferro-electric phase transition in a polar liquid and the nature of lambda-transition in supercooled water
Posted on August 18, 2008 | View CommentsWater is a major and all-important example of a strongly interacting polar liquid. Dielectric properties of water surrounding nano-scale objects pose a fundamentally important problem in physics, chemistry, structural biology and in silica drug design. The issue of temperature dependence of dielectric constant, the role...