796 search results - page 8 / 160 » Molecular Surface Abstraction |
EUROGP
2004
Springer
15 years 4 months ago
2004
Springer
Abstract. In this paper we consider a new class of search and optimization algorithms inspired by molecular dynamics simulations in physics.
JSC
2007
14 years 11 months ago
2007
Abstract: This note describes the current reimplementation of mathscape that supports all the calculations in my paper ”Mathscapeand Molecular Integrals”.
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ICCABS
2011
14 years 3 months ago
2011
—Research efforts to analyze biomolecular properties contribute towards our understanding of biomolecular function. Calculating non-bonded forces (or in our case, electrostatic s...
SIAMSC
2011
14 years 5 months ago
2011
In order to compute polarization energy of biomolecules, we describe a boundary element approach to solving the linearized Poisson–Boltzmann equation. Our approach combines sever...
JCC
2006
14 years 11 months ago
2006
: Heuristic molecular lipophilicity potential (HMLP) is applied in the study of lipophilicity and hydrphilcity of 20 natural amino acids side chains. The HMLP parameters, surface a...