Michael E. Pique

Computational Theory and Mathematics · 2016

A researcher in the Science corpus: 1 paper; trusts 1 researcher and is trusted by 0 researchers here, as inferred from the citation graph.

Subfields

Whom Michael E. Pique trusts

Their strongest outbound trust, strongest first, inferred from their citations.

  1. Arthur J. Olson (in Computational Theory and Mathematics)

Papers from Michael E. Pique's perspective

Ordered by how strongly the researchers Michael E. Pique trusts endorse each paper. Same corpus, a different order for every researcher.

  1. Virtual Screening with AutoDock: Theory and Practice (Expert Opinion on Drug Discovery)
  2. AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization and multithreading
  3. AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility
  4. Covalent docking using autodock: Two‐point attractor and flexible side chain methods
  5. Prediction of protein-ligand interactions. Docking and scoring: successes and gaps. (Journal of Medicinal Chemistry)
  6. Protein–ligand docking: Current status and future challenges
  7. A semiempirical free energy force field with charge‐based desolvation (Journal of Computational Chemistry)
  8. Computational drug design accommodating receptor flexibility: the relaxed complex scheme. (Journal of the American Chemical Society)
  9. Automated docking to multiple target structures: Incorporation of protein mobility and structural water heterogeneity in AutoDock (Proteins: Structure, Function, and Bioinformatics)
  10. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings.

Their papers