A reformulation of the projection variation method
β Scribed by Anthea Grubb
- Publisher
- Elsevier Science
- Year
- 1982
- Tongue
- English
- Weight
- 168 KB
- Volume
- 89
- Category
- Article
- ISSN
- 0375-9601
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## Abstract Two new chargeβscaling methods for efficient modeling of the solvated macromolecular environment in hybrid QM/MM calculations of biological reactions are presented. The methods are extensions of the variational electrostatic projection (VEP) method, and allows a subset of atomic charges
In this paper, we consider and analyze a new class of projection methods for solving pseudomonotone general variational inequalities using the Wiener-Hopf equations technique. The modified methods converge for pseudomonotone operators. Our proof of convergence is very simple as compared with other m