Results 91 to 100 of about 3,086 (177)

SLICE (SMARTS and Logic In ChEmistry): fast generation of molecules using advanced chemical synthesis logic and modern coding style. [PDF]

J Cheminform
Ilemo SN, Delannée V, Grushin O, Judson P, Patel H, Nicklaus MC, Tarasova NI.   +6 more
europepmc   +1 more source

Generalized Revenge. [PDF]

Australas J Philos, 2020
Murzi J, Rossi L.
europepmc   +1 more source

Quantitative evaluation of explainable graph neural networks for molecular property prediction. [PDF]

Patterns (N Y), 2022
Rao J, Zheng S, Lu Y, Yang Y.
europepmc   +1 more source

A comprehensive N-glycoproteome atlas reveals tissue-specific glycan remodeling but non-random structural microheterogeneities. [PDF]

Nat Commun
Wu Y, Yang M, Xu Y, Jia L, Li J, Wang X, Zhao J, Cai Y, Zhang Y, Sun S.   +9 more
europepmc   +1 more source

ADMETlab 2.0: an integrated online platform for accurate and comprehensive predictions of ADMET properties. [PDF]

Nucleic Acids Res, 2021
Xiong G, Wu Z, Yi J, Fu L, Yang Z, Hsieh C, Yin M, Zeng X, Wu C, Lu A, Chen X, Hou T, Cao D.   +12 more
europepmc   +1 more source

Advancing Drug-Drug Interaction Prediction with Biomimetic Improvements: Leveraging the Latest Artificial Intelligence Techniques to Guide Researchers in the Field. [PDF]

Biomimetics (Basel)
Marqas RB, Simó Z, Mousa A, Özyurt F, Iantovics LB.   +4 more
europepmc   +1 more source

Where Mathematical Symbols Come From. [PDF]

Top Cogn Sci
Schlimm D.
europepmc   +1 more source

A High-Performance and Interpretable p<i>K</i>_a Prediction Framework Integrating Count-Based Fingerprints and Ensemble Learning. [PDF]

Molecules
Shen H, He Y, Deng J, Li X, Yang C, Ma D, Xia D, Yu H.   +7 more
europepmc   +1 more source

Machine Learning-Enabled Parallel Prediction and Co-Design of Polyimides for Tailored Glass Transition, Dielectric, and Bandgap Properties. [PDF]

ACS Omega
Liang B, Huo W, Wu X, Zheng R.
europepmc   +1 more source

Semantic Cut Elimination for the Logic of Bunched Implications and Structural Extensions, Formalized in Coq

, 2022
Frumin D.
europepmc   +1 more source