Biology subjects

Swetnam, T. L.

Publications and source records attributed to Swetnam, T. L..

4 recordsLinked to original sources

bioRxiv2024

MDRepo - an open environment for data warehousing and knowledge discovery from molecular dynamics simulations

BackgroundMolecular Dynamics (MD) simulation of biomolecules provides important insights into conformational changes and dynamic behavior, revealing critical information about folding and interactions with other molecules. This enables advances in drug discovery and the design of therapeutic interventions. The collection of simulations stored in computers across the world holds immense potential to serve as training data for future Machine Learning models that will transform the prediction of structure, dynamics, drug interactions, and more. A needIdeally, there should exist an open access repository that enables scientists to submit and store their MD simulations of proteins and protein-drug interactions, and to find, retrieve, analyze, and visualize simulations produced by others. However, despite the ubiquity of MD simulation in structural biology, no such repository exists; as a result, simulations are instead stored in scattered locations without uniform metadata or access protocols. A solutionHere, we introduce MDRepo, a robust infrastructure that supports a relatively simple process for standardized community contribution of simulations, activates common downstream analyses on stored data, and enables search, retrieval, and visualization of contributed data. MDRepo is built on top of the open-source CyVerse research cyberinfrastructure, and is capable of storing petabytes of simulations, while providing high bandwidth upload and download capabilities and laying a foundation for cloud-based access to its stored data.

biochemistry↗

bioRxiv2023

CyVerse: Cyberinfrastructure for Open Science

CyVerse, the largest publicly-funded open-source research cyberinfrastructure for life sciences, has played a crucial role in advancing data-driven research since the 2010s. As the technology landscape evolved with the emergence of cloud computing platforms, machine learning and artificial intelligence (AI) applications, CyVerse has enabled access by providing interfaces, Software as a Service (SaaS), and cloud-native Infrastructure as Code (IaC) to leverage new technologies. CyVerse services enable researchers to integrate institutional and private computational resources, custom software, perform analyses, and publish data in accordance with open science principles. Over the past 13 years, CyVerse has registered more than 110,000 verified accounts from 160 countries and was used for over 1,600 peer-reviewed publications. Since 2011, 45,000 students and researchers have been trained to use CyVerse. The platform has been replicated and deployed in two countries outside the US, with additional private deployments on commercial clouds for US government agencies and multinational corporations. In this manuscript, we present a strategic blueprint for creating and managing SaaS cyberinfrastructure and IaC as free and open-source software.

scientific communication and education↗

bioRxiv2021

Innovations to expand drone data collection and analysis for rangeland monitoring

In adaptive management of rangelands, monitoring is the vital link that connects management actions with on-the-ground changes. Traditional field monitoring methods can provide detailed information for assessing the health of rangelands, but cost often limits monitoring locations to a few key areas or random plots. Remotely sensed imagery, and drone-based imagery in particular, can observe larger areas than field methods while retaining high enough spatial resolution to estimate many rangeland indicators of interest. However, the geographic extent of drone imagery products is often limited to a few hectares (for resolution [≤] 1 cm) due to image collection and processing constraints. Overcoming these limitations would allow for more extensive observations and more frequent monitoring. We developed a workflow to increase the extent and speed of acquiring, processing, and analyzing drone imagery for repeated monitoring of two common indicators of interest to rangeland managers: vegetation cover and vegetation heights. By incorporating a suite of existing technologies in drones (real-time kinematic GPS), data processing (automation with Python scripts, high performance computing), and cloud-based analysis (Google Earth Engine), we greatly increased the efficiency of collecting, analyzing, and interpreting high volumes of drone imagery for rangeland monitoring. End-to-end, our workflow took 30 days, while a workflow without these innovations was estimated to require 141 days to complete. The technology around drones and image analysis is rapidly advancing which is making high volume workflows easier to implement. Larger quantities of monitoring data will significantly improve our understanding of the impact management actions have on land processes and ecosystem traits.

ecology↗

bioRxiv2016

Fusing tree-ring and forest inventory data to infer influences on tree growth

Better understanding and prediction of tree growth is important because of the many ecosystem services provided by forests and the uncertainty surrounding how forests will respond to anthropogenic climate change. With the ultimate goal of improving models of forest dynamics, here we construct a statistical model that combines complementary data sources - tree-ring and forest inventory data. A Bayesian hierarchical model is used to gain inference on the effects of many factors on tree growth - individual tree size, climate, biophysical conditions, stand-level competitive environment, tree-level canopy status, and forest management treatments - using both diameter at breast height (DBH) and tree-ring data. The model consists of two multiple regression models, one each for the two data sources, linked via a constant of proportionality between coefficients that are found in parallel in the two regressions. The model was applied to a dataset developed at a single, well-studied site in the Jemez Mountains of north-central New Mexico, U. S. A. Inferences from the model included positive effects of seasonal precipitation, wetness index, and height ratio, and negative effects of seasonal temperature, southerly aspect and radiation, and plot basal area. Climatic effects inferred by the model compared well to results from a dendroclimatic analysis. Combining the two data sources did not lead to higher predictive accuracy (using the leave-one-out information criterion, LOOIC), either when there was a large number of increment cores (129) or under a reduced data scenario of 15 increment cores. However, there was a clear advantage, in terms of parameter estimates, to the use of both data sources under the reduced data scenario: DBH remeasurement data for ~500 trees substantially reduced uncertainty about non-climate fixed effects on radial increments. We discuss the kinds of research questions that might be addressed when the high-resolution information on climate effects contained in tree rings are combined with the rich metadata on tree- and stand-level conditions found in forest inventories, including carbon accounting and projection of tree growth and forest dynamics under future climate scenarios.

ecology↗