An electrostatic model based on charge density is proposed as a model for future force fields. The model is composed of a nucleus and a single Slater-type contracted Gaussian multipole charge density on each atom. The Gaussian multipoles are fit to the electrostatic potential (ESP) calculated at the B3LYP/6-31G* and HF/aug-cc-pVTZ levels of theory and tested by comparing electrostatic dimer ene...

In this short document, we derive a tree-independent single-tree algorithm for Gaussian mixture model training, based on a technique proposed by Moore [8]. Here, the solution we provide is tree-independent and thus will work with any type of tree and any type of traversal; this is more general than Moore’s original formulation, which was limited to mrkd-trees. This allows us to develop a flexib...

We generalize the classical max-min rate allocation policy with the support of the minimum rate requirement and peak rate constraint for each connection. Since a centralized algorithm for the generalized maxmin (GMM) rate allocation requires global information, which is difficult to maintain and manage in a large network, we develop a distributed protocol to achieve the GMM policy using the ava...

In this paper we present techniques for efficient speaker recognition of a large population of speakers and for efficient speaker retrieval in large audio archives. We deal with aspects of both time and storage. We use Gaussian mixture modeling (GMM) for representing both train and test sessions and show how to perform speaker recognition and retrieval efficiently with only a small degradation ...

This paper addresses the "one-to-many" mapping problem in Voice Conversion (VC) by exploring source-to-target mappings in GMM-based spectral transformation. Specifically, we examine differences using source-only versus joint source/target information in the classification stage of transformation, effectively illustrating a "one-to-many effect" in the traditional acoustically-based GMM. We propo...

Gaussian Mixture Model (GMM) computation is known to be one of the most computation-intensive components in speech decoding. In our previous work, context-independent model based GMM selection (CIGMMS) was found to be an effective way to reduce the cost of GMM computation without significant loss in recognition accuracy. In this work, we propose three methods to further improve the performance ...

We present semiparametric spectral modeling of the complete larval Drosophila mushroom body connectome. Motivated by a thorough exploratory data analysis of the network via Gaussian mixture modeling (GMM) in the adjacency spectral embedding (ASE) representation space, we introduce the latent structure model (LSM) for network modeling and inference. LSM is a generalization of the stochastic bloc...