Evalix: Classification and Prediction of Job Resource Consumption on HPC Platforms

Vehicular mobility model optimization using cooperative coevolutionary genetic algorithms

Comparative analysis of different environmental loading methods and their impacts on the GPS height time series

Prescriptions for Network Strategy: Does Evidence of Network Effects in Cross-Section Support them?

Machine Learning-Based Malware Detection for Android Applications: History Matters!

Desperately Seeking Small Worlds in Corporate Boards: International Evidence from Listed Firms

Quality assessment of Mulit-Year BLT Tide Gauge Benchmark Monitoring (TIGA) repro2 Solution

A force-constant model of graphene for conductivity calculations

Evolutionary Multi-Objective Optimisation with Quantile Constraint for the Protein Structure Similarity Problem

Evolutionary multi objective optimisation with diversity as objective for the protein structure similarity problem

Are Your Training Datasets Yet Relevant? - An Investigation into the Importance of Timeline in Machine Learning-Based Malware Detection

Website Fingerprinting at Internet Scale

Ab-initio study of the temperature effects on the optical properties of transition metal dichalcogenides

A Novel Multi-objectivisation Approach for Optimising the Protein Inverse Folding Problem

NK Landscape Instances Mimicking the Protein Inverse Folding Problem Towards Future Benchmarks

EvoSuite at the SBST 2015 Tool Competition

Generating TCP/UDP Network Data for Automated Unit Test Generation

Overcoming partitioning in large ad hoc networks using genetic algorithms

Information Dissemination in VANETs based upon a Tree Topology

On the Resilience of the Newscast Protocol in the Presence of Cheaters

Unified Description of the Optical Phonon Modes in N-Layer MoTe2

Moiré-induced replica of graphene phonons on Ir(111)

Multi-objective Robust Static Mapping of Independent Tasks on Grids

Iterated Local Search for de Novo Genomic Sequencing

A Cellular Genetic Algorithm for Scheduling Applications and Energy-Aware Communication Optimization

Cooperative Selection: Improving Tournament Selection via Altruism

Distributed Cellular Evolutionary Algorithms in a Byzantine Environment

k-Metric Antidimension: a Privacy Measure for Social Graphs

ASSA-PBN: An approximate steady-state analyser for probabilistic Boolean networks

Electronic and Vibrational proprieties of graphene on Ir(111) and SiC(100)

An evaluation of multi-GNSS zenith tropospheric delay products based on real-time satellite products

Empirical assessment of machine learning-based malware detectors for Android: Measuring the Gap between In-the-Lab and In-the-Wild Validation Scenarios

Novel efficient asynchronous cooperative co-evolutionary multi-objective algorithms

New State-of-the-art Results for Cassini2 Global Trajectory Optimization Problem

Satellite Payload Reconfiguration Optimisation: An ILP Model

Optimising Satellite Payload Reconfiguration: An ILP Approach for Minimising Channel Interruptions

A New Parallel Multi-objective Cooperative Coevolutionary Algorithm Based on SPEA2

Hybrid Cellular Genetic Algorithm for Global Trajectory Optimization Problem

Improving Classical and Decentralized Differential Evolution with New Mutation Operator and Population Topologies

Study of Different Small-world Topology Generation Mechanisms for Genetic Algorithms

Differential Evolution Algorithms with Cellular Populations

Adaptive Neighborhoods for Cellular Genetic Algorithms

On the use of Small-world Population Topologies for Genetic Algorithms

Using Data-flow analysis in MAS for power-aware HPC runs

On the Resilience of [distributed] Evolutionary Algorithms against Cheaters in Global Computing Platforms

Energy-Aware Fast Scheduling Heuristics in Heterogeneous Computing Systems

Optimizing AEDB Broadcasting Protocol with Parallel Multi-objective Cooperative Coevolutionary NSGAII

Resolution of Different Length Scales by an Efficient Combination of the Finite Element Method and the Discrete Element Method

Simulation des Traktionsverhaltens von Reifen auf granularem Untergrund durch eine Kopplung zwischen der Finiten (FEM) und der Diskreten Element Methode (DEM)

XDEM - FEM Coupling Simulations of the Interactions between a Tire Tread and Granular Terrain

Energy Efficiency on Scalable Computing Architectures

Performance Analysis of Cloud Environments on Top of Energy-Efficient Platforms Featuring Low Power Processors

Dependency Analysis for Critical Infrastructure Security Modelling: A Case Study within the Grid'5000 Project

Trust Based Interdependency Weighting for On-line Risk Monitoring in Interdependent Critical Infrastructures

HPC Performance and Energy-Efficiency of the OpenStack Cloud Middleware

Analysis of the Data Flow in the Newscast Protocol for Possible Vulnerabilities

Performance tuning of applications in HPC environments employing Simulated Annealing

3D DEM – FEM Coupling to Analyse the Tractive Performance of Different Tire Treads in Soil

Management of an Academic HPC Cluster: The UL Experience

UAV fleet area coverage with network connectivity constraint

Improving Credit Card Fraud Detection with Calibrated Probabilities

Crystal growth from a supersaturated melt: Relaxation of the solid-liquid dynamic stiffness

Crystallization mechanism in melts of short n-alkane chains

Example-Dependent Cost-Sensitive Logistic Regression for Credit Scoring

Solid phase properties and crystallization in simple model systems

Crystal nucleation mechanism in melts of short polymer chains under quiescent conditions and under shear flow

Strong Effect ofWeak Charging in Suspensions of Anisotropic Colloids

Infuence of random pinning on the crystallization process in suspensions of hard spheres

CERTICLOUD, une plate-forme Cloud IaaS sécurisée

Hash function generation by means of Gene Expression Programming

ShadObf: A C-source Obfuscator based on Multi-objective Optimization Algorithms

Expected Running Time of Parallel Evolutionary Algorithms on Unimodal Pseudo-Boolean Functions over Small-World Networks

CertiCloud: a Novel TPM-based Approach to Ensure Cloud IaaS Security

CertiCloud: une plate-forme Cloud IaaS sécurisée

Performance Evaluation and Energy Efficiency of High-Density HPC Platforms Based on Intel, AMD and ARM Processors

A Signature Scheme for Distributed Executions based on Control flow Analysis..

On the Resilience of [Distributed] EAs against Cheaters in Global Computing Platforms

Une approche génétique et source à source de l'optimisation de code

Scheduling DAG applications on multi-core processor packages architectures

Parallel implementation of domain decomposition algorithm for molecular dynamics

Comparison of Multi-objective Optimization Algorithms for the JShadObf JavaScript Obfuscator

Dynamic Adaptation Applied to Sabotage Tolerance

Cheating impact on distributed Evolutionary Algorithms over BOINC computations.

The Flexible Rare Event Sampling Harness System (FRESHS)

ILQINS hexapeptide, identified in lysozyme left-handed helical ribbons and nanotubes, forms right-handed helical ribbons and crystals.

Free Energies by Thermodynamic Integration Relative to an Exact Solution, Used to Find the Handedness-Switching Salt Concentration for DNA

Evolutionary algorithms based on game theory and cellular automata with coalitions

Designing a Self-organized Approach for Scheduling Bag-of-Tasks

A Multithreading Local Search For Multiobjective Energy-Aware Scheduling In Heterogeneous Computing Systems

Optimization and Performance Analysis of the AEDB Broadcasting Algorithm

Minimising longest path length in communication satellite payloads via metaheuristics

An Overlay Approach for Optimising Small-World Properties in VANETs

Reducing Efficiency of Connectivity-Splitting Attack on Newscast via Limited Gossip

SOFIA: An Automated Security Oracle for Black-Box Testing of SQL-Injection Vulnerabilities

Ranking big performance tableaux with multiple incommensurable criteria and missing data

Impact of Antenna Phase Centre Calibrations on Position Time Series: Preliminary Results

Scalable and Energy-Efficient Scheduling Techniques for Large-Scale Systems

Impact of Voltage Levels Number for Energy-aware Bi-objective DAG Scheduling for Multi-processors Systems

Enhanced Thermal Process Engineering by the Extended Discrete Element Method (XDEM)

Chaos-enhanced mobility models for multilevel swarms of UAVs

Die Extended Discrete Element Method (XDEM) für multiphysikalische Anwendungen

First Vertical Land Movement Estimates on South Georgia Island: An Impact Study on Sea Level Change from Tide Gauge and Altimetry Measurements

On the Scientific Applications of IGS Products: An Assessment of the Reprocessed TIGA Solutions and Combined Products

The extended discrete element method (XDEM) for multi-physics applications

eXtended Discrete Element Method used for convective heat transfer predictions

Application of the Extended Discrete Element Method (XDEM) in Computer-Aided Process Engineering

Multi-physikalische Anwendungen mit der Extended Discrete Element Method (XDEM)

Simulation von reagierenden Mehrphasen- strömungen mit der Extended Discrete Element Method (XDEM)

The Extended Discrete Element Method (XDEM) for Multi-Physics Applications

The extended discrete element method (XDEM) for multi-physics applications

Application of XDEM as a novel approach to predict drying of a packed bed

Detailed numerical modeling of pyrolysis in a heterogeneous packed bed using XDEM

An Efficient 3D FEM - DEM Coupling for Granular Matter Applications

Extended Discrete Element Method (XDEM) to Model Heterogeneous Reactions in Packed Beds

Die Extended Discrete Element Method (XDEM) als integraler Ansatz für reagierende Mehrphasenströmungen

From Random Process to Chaotic Behavior in Swarms of UAVs

Towards Connectivity Improvement in VANETs using Bypass Links

Vulnerability Prediction Models: A case study on the Linux Kernel

A Discrete Approach to Describe the Kinematics between Snow and a Tire Tread

Automatic Search for Differential Trails in ARX Ciphers

Differential Analysis of Block Ciphers SIMON and SPECK

Evaluation of ERA-Interim for tropospheric delay and water vapour estimation in different climate zones using ground-based GNSS observations

Monolayers of hard rods on planar substrates. II. Growth

A Multi-Year Combination of Tide Gauge Benchmark Monitoring (TIGA) Analysis Center Products

Impact du mécanisme chaotique sur l’optimisation d’un modèle de mobilité pour un essaim de drones devant réaliser une couverture de zone

Noise characteristics in Zenith Total Delay from homogeneously reprocessed GPS time series

Monolayers of hard rods on planar substrates: I. Equilibrium

A New Global Vertical Land Movement Data Set from the TIGA Combined

Computing linear rankings from trillions of pairwise outranking situations

Isotropic-nematic transition and cholesteric phases of helical Yukawa rods

Enhancing Self-Assembly in Cellulose Nanocrystal Suspensions Using High-Permittivity Solvents

Sea Level Changes, Monitoring of Vertical Land Movements and TIGA Activities

Global Navigation Satellite System (GNSS) at Tide Gauge Installations in the South Atlantic Ocean

A Global Vertical Land Movement Data Set from a Combination of Global Navigation Satellite System Solutions

Energy-Aware Scheduling of Parallel Applications with Multi-Objective Evolutionary Algorithm

Finding a robust configuration for the AEDB information dissemination protocol for mobile ad hoc networks

Solving the three dimensional quadratic assignment problem on a computational grid

Online Bi-Objective Scheduling for IaaS Clouds Ensuring Quality of Service

Amazon Elastic Compute Cloud (EC2) vs. in-House HPC Platform: a Cost Analysis

Vertical Land Movements and Sea Level Changes around South Georgia Island

Generating Multi-Categorical Samples with Generative Adversarial Networks

Bayesian optimization to enhance coverage performance of a swarm of UAV with chaotic dynamics

Measuring data locality ratio in virtual MapReduce cluster using WorkflowSim

Next Generation Computing and Storage at Scale: Overview and Implementation within the European HPC strategy

Large-scale research data management: Road to GDPR compliance

Statistical significance of trends in Zenith Wet Delay from re-processed GPS solutions

Exploiting the Hard-wired Vulnerabilities of Newscast via Connectivity-splitting Attack

PRESENCE: Performance Metrics Models for Cloud SaaS Web Services

Effect of unmodelled tidal displacements in GPS and GLONASS coordinate time series

An Offline Dictionary Attack Against zkPAKE Protocol

Interlayer and intralayer excitons in MoS2/WS2 and MoSe2/WSe2 heterobilayers

TREM2 triggers microglial density and age‐related neuronal loss

Temporal enhancer profiling of parallel lineages identifies AHR and GLIS1 as regulators of mesenchymal multipotency

PRESEnCE: A Framework for Monitoring, Modelling and Evaluating the Performance of Cloud SaaS Web Services

Hybrid MPI+OpenMP Implementation of eXtended Discrete Element Method

First-principles stability ranking of molecular crystal polymorphs with the DFT+MBD approach

On Verifying and Assuring the Cloud SLA by Evaluating the Performance of SaaS Web Services Across Multi-cloud Providers

Overview and Challenges of the UL HPC Facility at the Belval and EuroHPC Horizon

Overview and Challenges of the UL HPC Facility at the Belval Horizon

Overview and Challenges of the UL HPC Facility at the EuroHPC Horizon

High Performance Computing (HPC) at UL: Overview (as of 2015) and Usage

HPC platforms @ UL: Overview (as of 2014) and Usage

Consolidating Observation of Land and Sea Level Changes around South Georgia Island

Ion-induced interactions in a Tomonaga-Luttinger liquid

An Empirical Analysis of Vulnerabilities in OpenSSL and the Linux Kernel

Kinetic Control of Parallel versus Antiparallel Amyloid Aggregation via Shape of the Growing Aggregate

Using the Vertical Land Movement estimates from the IGS TIGA combined solution to derive Global Mean Sea Level changes

Vibrational and optical properties of MoS2: From monolayer to bulk

Amyloid Evolution: Antiparallel Replaced by Parallel

Displacement based polytopal elements a strain smoothing and scaled boundary approach

XDEM: from HPC to the Cloud

Optimised biomolecular extraction for metagenomic analysis of microbial biofilms from high-mountain streams

Evolution of Conformation, Nanomechanics, and Infrared Nanospectroscopy of Single Amyloid Fibrils Converting into Microcrystals

Evaluating Model Testing and Model Checking for Finding Requirements Violations in Simulink Models

How Evolutionary Algorithms and Information Hiding deceive machines and humans for image recognition: A research program

Mining Assumptions for Software Components using Machine Learning

Generating Automated and Online Test Oracles for Simulink Models with Continuous and Uncertain Behaviors

Dynamic composition of solvers for coupled problems in DOLFINx

Approximation-Refinement Testing of Compute-Intensive Cyber-Physical Models: An Approach Based on System Identification

Protection of Personal Data in High Performance Computing Platform for Scientific Research Purposes

Uni.lu HPC Annual Report 2020

PRACE Best Practice Guide 2020: Modern Processors

PRACE Best Practice Guide 2021: Modern Accelerators

Edge Computing: An Overview of Framework and Applications

The early crystal nucleation process in hard spheres shows synchronised ordering and densification

Absolute Free Energies for Biomolecules in Implicit or Explicit Solvent

Cytokine-mediated modulation of the hepatic miRNome: miR-146b-5p is an IL-6-inducible miRNA with multiple targets.

DNA partitions into triplets under tension in the presence of organic cations, with sequence evolutionary age predicting the stability of the triplet phase

High Performance Parallel Coupling of OpenFOAM+XDEM

Short Introduction to the Roofline Model

Early Pleistocene enamel proteome from Dmanisi resolves Stephanorhinus phylogeny.

Achieving super-linear performance in parallel multi-objective evolutionary algorithms by means of cooperative coevolution

Automatic Software Tuning of Parallel Programs for Energy-Aware Executions

Markov Chain Monte Carlo and the Application to Geodetic Time Series Analysis

MULTI-GNSS ERROR CHARACTERISTICS AND BENEFITS TO LONG-TERM MONITORING APPLICATIONS IN GEOSCIENCES

Optimized Collision Search for STARK-Friendly Hash Challenge Candidates

First-Principles Modeling of Molecular Crystals: Crystal Structure Prediction and Vibrational Properties

Amazon Elastic Compute Cloud (EC2) versus In-House HPC Platform: A Cost Analysis

Competition between crystal and fibril formation in molecular mutations of amyloidogenic peptides

Optimisation of the enhanced distance based broadcasting protocol for MANETs

A two-phase heuristic for the energy-efficient scheduling of independent tasks on computational grids

Comparing the Performance and Power Usage of GPU and ARM Clusters for Map-Reduce

HPC Performance and Energy-Efficiency of Xen, KVM and VMware Hypervisors

Performance tuning of applications for HPC systems employing Simulated Annealing optimization

A Holistic Model of the Performance and the Energy-Efficiency of Hypervisors in an HPC Environment

Evaluating the HPC Performance and Energy-Efficiency of Intel and ARM-based systems with synthetic and bioinformatics workloads

Cell type-selective disease-association of genes under high regulatory load

Evolutionary Algorithms for Convolutional Neural Network Visualisation

Diversity Preserving Genetic Algorithms - Application to the Inverted Folding Problem and Analogous Formulated Benchmarks

On the Properties of Zenith Total Delay Time Series from Reprocessed GPS Solutions

Status of TIGA activities at the British Isles continuous GNSS Facility and the University of Luxembourg

Coverage optimization with connectivity preservation for UAV swarms applying chaotic dynamics

UL HPC users'session: Mastering big data

First-principles modeling of chemistry in mixed solvents: Where to go from here?

Performance Analysis of Distributed and Scalable Deep Learning

DCcov: Repositioning of drugs and drug combinations for SARS-CoV-2 infected lung through constraint-based modeling.

Proximal Policy Optimisation for a Private Equity Recommitment System

A Holistic Model of the Performance and the Energy-Efficiency of Hypervisors in an HPC Environment

Security in an evolving European HPC Ecosystem

Reduced sialylation triggers homeostatic synapse and neuronal loss in middle-aged mice

Cryptanalysis of the Legendre PRF and generalizations

Systematic transcriptional profiling of responses to STAT1- and STAT3- activating cytokines in different cancer types

Phagocytosis‐related NADPH oxidase 2 subunit gp91phox contributes to neurodegeneration after repeated systemic challenge with lipopolysaccharides

Focal adhesion kinase plays a dual role in TRAIL resistance and metastatic outgrowth of malignant melanoma

Temperature-dependent excitonic effects in the optical properties of single-layer MoS2

Phonon-limited carrier mobility and resistivity from carbon nanotubes to graphene

Connectivity percolation in suspensions of attractive square-well spherocylinders

Excitonic-insulator instability and Peierls distortion in one-dimensional semimetals

Deskilling HPL - Using an Evolutionary Algorithm to Automate Cluster Benchmarking

Evolutionary Learning of Private Equity Recommitment Strategies

The gut microbial metabolite formate exacerbates colorectal cancer progression

PRESENCE: Monitoring and Modelling the Performance Metrics of Mobile Cloud SaaS Web Services

Aggregating and Consolidating two High Performant Network Topologies: The ULHPC Experience

Degree Adjusted Large-Scale Network Analysis Reveals Novel Putative Metabolic Disease Genes.

Optimizing the Resource and Job Management System of an Academic HPC and Research Computing Facility

Obfuscating LLVM Intermediate Representation Source Code with NSGA-II

Resilience within Ultrascale Computing System: Challenges and Opportunities from Nesus Project

ULHPC School 2020 Keynote: Overview and Challenges of the UL HPC Facility at the EuroHPC Horizon

Overview and Challenges of the UL HPC Facility at the EuroHPC Horizon

Overview and Challenges of the UL HPC Facility at the EuroHPC Horizon

UL HPC Facility Workload Analysis

The new AION cluster: Overview, Technical specifications and Capabilities

A Variant of Concurrent Constraint Programming on GPU

Solvent hydrodynamics speed up crystal nucleation in suspensions of hard spheres

Minimum Dependencies Energy-Efficient Scheduling in Data Centers

Metaheuristics for the Virtual Machine Mapping Problem in Clouds

RESIF 3.0: Toward a Flexible & Automated Management of User Software Environment on HPC facility

The Next Generation of Beam Hopping Satellite Systems: Dynamic Beam Illumination with Selective Precoding

The three-center two-positron bond

Management of an Academic HPC Research Computing Facility: The ULHPC Experience 2.0

Quantum machine learning corrects classical forcefields: Stretching DNA base pairs in explicit solvent

Spin-tunable thermoelectric performance in monolayer chromium pnictides

Strategy and Feasibility Study for the Construction of High Resolution Images Adversarial Against Convolutional Neural Networks

Parallel Coupling of CFD-DEM simulations

Empirical Perturbation Analysis of Two Adversarial Attacks: Black Box versus White Box

kCV-B: Bootstrap with Cross-Validation for Deep Learning Model Development, Assessment and Selection

A differential network analysis approach for lineage specifier prediction in stem cell subpopulations

Improving Machine Learning-based Prediction of Frailty in Elderly People with Digital Wearables : Data from the Berlin Aging Study II (BASE-II)

Novel Geometric Deep Learning Surrogate Framework for Non-Linear Finite Element Simulations

Efficient interatomic descriptors for accurate machine learning force fields of extended molecules

Optimized Quantum Drude Oscillators for Atomic and Molecular Response Properties

Validating the Transition Criteria from the Cassie−Baxter to the Wenzel State for Periodically Pillared Surfaces with Lattice Boltzmann Simulations

Handwritten Text Recognition for Documentary Medieval Manuscripts

Selecting a conceptual hydrological model using Bayes' factors computed with Replica Exchange Hamiltonian Monte Carlo and Thermodynamic Integration

Expanding the Disease Network of Glioblastoma Multiforme via Topological Analysis.

Machine learning-based prediction of frailty in elderly people : Data from the Berlin Aging Study II (BASE-II)

JoVe-FL - A Joint-embedding Vertical Federated Learning Framework

A split-training approach to JoVe-FL

Metabolic modelling-based in silico drug target prediction identifies six novel repurposable drugs for melanoma

Revisiting Meet-in-the-Middle Cryptanalysis of SIDH/SIKE with Application to the $IKEp182 Challenge

Effective and Efficient Structural Inference with Reservoir Computing

Active Learning based Structural Inference

ShuffleDetect: Detecting Adversarial Images against Convolutional Neural Networks

On the angular anisotropy of the randomly averaged magnetic neutron scattering cross section of nanoparticles

One evolutionary algorithm deceives humans and ten convolutional neural networks trained on ImageNet at image recognition

CONVERGENCE TIME ANALYSIS OF ASYNCHRONOUS DISTRIBUTED ARTIFICIAL NEURAL NETWORKS

Tutorials for using the Digraph3 Python software collection

A strategy creating high-resolution adversarial images against convolutional neural networks and a feasibility study on 10 CNNs

Challenges in Automatic Software Optimisation: the energy efficiency case

Novel deep learning approaches for learning scientific simulations

scFASTCORMICS: A Contextualization Algorithm to Reconstruct Metabolic Multi-Cell Population Models from Single-Cell RNAseq Data

Experimental and Theoretical Investigations for the improvement of AGMD Energy Efficiency

Micromagnetic simulation of neutron scattering from spherical nanoparticles: Effect of pore-type defects

Constraint Programming with External Worst-Case Traversal Time Analysis

Quantum Drude oscillators coupled with Coulomb potential as an efficient model for bonded and non-covalent interactions in atomic dimers

Data Driven Surrogate Frameworks for Computational Mechanics: Bayesian and Geometric Deep Learning Approaches

The FEniCS Project on AWS Graviton3

Constraint Model for the Satellite Image Mosaic Selection Problem

Hierarchical a posteriori error estimation of Bank-Weiser type in the FEniCS Project

An a posteriori error estimator for the spectral fractional power of the Laplacian

A Toolkit for Reliable Benchmarking and Research in Multi-Objective Reinforcement Learning

Pore-Level Multiphase Simulations of Realistic Distillation Membranes for Water Desalination.

A Parallel Multi-Objective Cooperative Coevolutionary Algorithm for Optimising Small-World Properties in VANETs

What can a swiped word tell us more? Demographic and behavioral correlates from shape-writing text entry

Theoretical and Numerical Constant Mean Curvature Surface and Liquid Entry Pressure Calculations for a Combined Pillar–Pore Structure

Scheduling Deep Learning Training in GPU Cluster Using the Model-Similarity-Based Policy

Universal Pairwise Interatomic van der Waals Potentials Based on Quantum Drude Oscillators.

Glacier shrinkage will accelerate downstream decomposition of organic matter and alters microbiome structure and function.

Multi-omics analysis of mouse fecal microbiome reveals supplier-dependent functional differences and novel metagenome-assembled genomes

Cross-domain interactions induce community stability to benthic biofilms in proglacial streams

Homogeneous selection promotes microdiversity in the glacier-fed stream microbiome

UniFuncNet: a flexible network annotation framework

2-Hydroxyglutarate modulates histone methylation at specific loci and alters gene expression via Rph1 inhibition.

The microbiome of cryospheric ecosystems.

Functional prediction of proteins from the human gut archaeome

FEniCSx Preconditioning Tools (FEniCSx-pctools)

Topological network measures in biological network analysis: Applications in novel disease-protein identification and drug-response predictions

Molecules in Environments: Toward Systematic Quantum Embedding of Electrons and Drude Oscillators