The Interoperability Challenge in DFT Workflows Across Implementations
Interoperability and cross‐validation remain major challenges in the computational materials science. In this work, we introduce a common input/output standard that enables internal translation across multiple workflow managers—AiiDA, PerQueue, Pipeline Pilot, and SimStack—while producing results in a unified schema.
Simon K. Steensen +13 more
wiley +1 more source
Tactile perception and tolerability thresholds of TMS characterized by intensity across locations and frequencies. [PDF]
Nesmith N +6 more
europepmc +1 more source
MolMiner: Toward Controllable, Three‐Dimensional‐Aware, Fragment‐Based Molecular Design
MolMiner is a fragment‐based, geometry‐aware, and order‐agnostic generative model for molecular design with strong inductive biases. Using symmetry‐aware fragment assembly, dynamic three‐dimensional geometry, and multi‐property conditioning, MolMiner enables interpretable and controllable molecular generation.
Raul Ortega‐Ochoa +2 more
wiley +1 more source
Whole-Genome Analysis of Bacillus Licheniformis Ali5 and Synthesis of Lichenysin via Genome Shuffling. [PDF]
Pang Z, Zhang B, Tao Z, Wang F.
europepmc +1 more source
Self‐Sensing Artificial‐Muscle‐Empowered Humanlike Perception, Interaction, and Positioning
The proposed self‐sensorized artificial muscle (SSAM) can sense its length change as small as 0.01 mm via a seamlessly integrated multi‐segment induction coil. The SSAM provides accurate length information regardless of its loadings, driving pressure, or muscle design, adequate for robust data‐driven feedback control.
Houping Wu +6 more
wiley +1 more source
Impact of hypertrophic pattern and obstruction on cardiovascular magnetic resonance myocardial strain and left atrioventricular coupling in hypertrophic cardiomyopathy: a retrospective study. [PDF]
Li Y, Li Z, Chen S, Long L.
europepmc +1 more source
It is a fact that slippage causes tracking errors in both longitudinal and lateral directions which results to have less travel distance in tracking a reference trajectory. Less travel distance means having energy loss of the battery and carrying loads less than planned.
Gokhan Bayar +2 more
wiley +1 more source
Structure-Driven Feature Modeling for Robust Fish Detection in Complex Underwater Environments. [PDF]
Wang Y +6 more
europepmc +1 more source
Dynamic Obstacle Avoidance of Metamorphic Microrobots Using Concentric Sector Navigator
Metamorphic magnetic microrobots are navigated using a concentric sector navigator for dynamic obstacle avoidance in both microroller and swarm states. After microroller transport, citrate‐triggered dissolution releases nanoparticles that reassemble into a controllable swarm.
Zhaowen Su +4 more
wiley +1 more source

