Results 51 to 60 of about 42,222 (303)
CLRe: A Synergistic Dual‐Engine Framework for One‐Step Retrosynthesis Prediction
Advanced Science, EarlyView.CLRe uses a contrastive difficulty score to order pretrained seq2seq fine‐tuning for retrosynthesis. Reaction embeddings define the ranking score, and a cumulative easy‐to‐hard schedule expands from the easiest subset to the full training set while earlier examples remain active.
Tianhao Su +5 more
wiley +1 more source
The Survival of Market Orientation through Artificial Selection
Annals of Business Administrative Science, 2016 Observations of a Japanese automobile dealer company shifting from a selling orientation to a market orientation revealed the following: (1) A market-oriented program with a process and team orientation threatened the self-concept of the sales force and ...
Ryusuke KOSUGE, Nobuo TAKAHASHI
doaj +1 more source
Graph Isomorphism is Not AC0-Reducible to Group Isomorphism [PDF]
ACM Transactions on Computation Theory, 2013 We give a new upper bound for the Group and Quasigroup Isomorphism problems when the input structures are given explicitly by multiplication tables. We show that these problems can be computed by polynomial size nondeterministic circuits of unbounded fan-in with O (log log n ) depth and
Chattopadhyay, Arkadev +2 more
openaire +4 more sources
Advanced Science, EarlyView.Non‐canonical amino acids (ncAAs) enhance peptide therapeutics but remain difficult to model computationally. SinCAA, a similarity‐enhanced pretraining framework, jointly optimizes contrastive learning guided by a novel conformational similarity metric with masked node reconstruction, capturing both functional relationships and chemical identity of ...
Chencheng Xu +8 more
wiley +1 more source
An isomorphism of unitals, and an isomorphism of classical groups [PDF]
, 2023 An isomorphism between two hermitian unitals is proved, and used to treat isomorphisms of classical groups that are related to the isomorphism between certain simple real Lie algebras of types A and D (and rank 3)
Stroppel, Markus Johannes
core +1 more source
Acta Crystallographica Section E: Crystallographic Communications, 2021 Lithium trisodium bis(sulfate) hexahydrate, LiNa3(SO4)2·6H2O was crystallized from aqueous solution at 298 K and the structure solved at different temperatures between 90 and 293 K.
Horst Schmidt +2 more
doaj +1 more source
Multi-Query Optimization for Subgraph Isomorphism Search
, 2016 Existing work on subgraph isomorphism search mainly focuses on a-query-at-a-time approaches: Optimizing and answering each query separately. When multiple queries arrive at the same time, sequential processing is not always the most efficient.
Ren, Xuguang, Wang, Junhu
core +1 more source
Testing graph isomorphism [PDF]
Proceedings of the seventeenth annual ACM-SIAM symposium on Discrete algorithm - SODA '06, 2006 Two graphs $G$ and $H$ on $n$ vertices are $\epsilon$-far from being isomorphic if at least $\epsilon\binom{n}{2}$ edges must be added or removed from $E(G)$ in order to make $G$ and $H$ isomorphic. In this paper we deal with the question of how many queries are required to distinguish between the case that two graphs are isomorphic and the case that ...
Eldar Fischer, Arie Matsliah
openaire +2 more sources
Advanced Intelligent Discovery, EarlyView.This research demonstrates that the combination of domain knowledge–based multiple regression, multi‐objective Bayesian optimization, and generative models is a suitable prediction tool for candidates of high refractive index polymers, even with the constraints in the model trained on limited data. The experimental validation can reproduce the proposed
Takuya Yokoo +3 more
wiley +1 more source
Journal of Business Economics and Management, 2014 There has been growing interest in green management practices among practitioners, researchers and regulators in recent years. However, there is limited research that examines the connection between natural environments and human resource management ...
A. Banu Goktan
doaj +1 more source