An overview of PATH⁺. by Yuxi Long (11024307)

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The 10 features captured by persistence fingerprint. by Yuxi Long (11024307)

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^aTwo HIV-1 protease mutants bound to inhibitor darunavir (G48V: PDB ID 3cyw [81] & L90M: PDB ID 2f81 [82]). by Yuxi Long (11024307)

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Scatter plots of PATH⁺ and our implementation of TNet-BP’s predictions on a held-out, test subset of PDBBind v2020 refined set for one run (90:10 train:test split ratio,... by Yuxi Long (11024307)

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PATH⁺ correctly predicted a weaker binding affinity for HIV-1 protease with the drug-resistant G48V mutation (right, experimental kcal/mol, PDB ID: 3cyw [81]) bound to d... by Yuxi Long (11024307)

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Performance of TNet-BP and PATH⁺ on the PDBBind v2020 refined set shows that PATH⁺ achieves similar performance with TNet-BP while having three orders fewer f... by Yuxi Long (11024307)

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Construction of internuclear persistence contours (IPCs). by Yuxi Long (11024307)

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Comparison of PATH⁺ with TNet-BP [43]. by Yuxi Long (11024307)

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The statistics of number of proteins and phosphorylation S/T/Y sites for different organisms. by Chao Wang (146527)

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Reward function related parameters. by Honglei Pang (22693724)

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Strong negative correlation between the precision of algorithms and the evolutionary distance from the training data. by Sven B. Gould (12237287)

EFGs: A Complete and Accurate Implementation of Ertl’s Functional Group Detection Algorithm in RDKit by Gonzalo Colmenarejo (650249)

“…In this paper, a new RDKit/Python implementation of the algorithm is described, that is both accurate and complete. …”

The AD-PSO-Guided WOA LSTM algorithm RMSE is based on the objective function compared to different algorithms. by Ahmed M. Elshewey (21463867)

“…<p>The AD-PSO-Guided WOA LSTM algorithm RMSE is based on the objective function compared to different algorithms.…”

Performance profile of the four algorithms based on the function value of iteration number. by Sulaiman M. Ibrahim (20614376)

“…<p>Performance profile of the four algorithms based on the function value of iteration number.…”

EELD problem solving process based on IALO algorithm. by Wenjing Wang (181404)

FAR-1: A Fast Integer Reduction Algorithm Compared to Collatz and Half-Collatz by Faizan Ali (21689861)

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Identification of big gaps between inferred protein angles. by Aimilia-Christina Vagiona (17584758)

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Comparison of Molecular Recognition in Docking Versus Experimental CSD and PDB Data by Andreas Tosstorff (8250999)

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Comparison of Molecular Recognition in Docking Versus Experimental CSD and PDB Data by Andreas Tosstorff (8250999)

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Comparison of Molecular Recognition in Docking Versus Experimental CSD and PDB Data by Andreas Tosstorff (8250999)

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