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384 in total

1. The sensitivity of the results of molecular docking to induced fit effects: application to thrombin, thermolysin and neuraminidase.

Authors: C W Murray; C A Baxter; A D Frenkel
Journal: J Comput Aided Mol Des Date: 1999-11 Impact factor: 3.686

2. MCDOCK: a Monte Carlo simulation approach to the molecular docking problem.

Authors: M Liu; S Wang
Journal: J Comput Aided Mol Des Date: 1999-09 Impact factor: 3.686

3. DREAM++: flexible docking program for virtual combinatorial libraries.

Authors: S Makino; T J Ewing; I D Kuntz
Journal: J Comput Aided Mol Des Date: 1999-09 Impact factor: 3.686

4. Statistical relationships among docking scores for different protein binding sites.

Authors: R T Koehler; H O Villar
Journal: J Comput Aided Mol Des Date: 2000-01 Impact factor: 3.686

5. Morphological similarity: a 3D molecular similarity method correlated with protein-ligand recognition.

Authors: A N Jain
Journal: J Comput Aided Mol Des Date: 2000-02 Impact factor: 3.686

6. Automated docking and molecular dynamics simulations of nimesulide in the cyclooxygenase active site of human prostaglandin-endoperoxide synthase-2 (COX-2).

Authors: R García-Nieto; C Pérez; F Gago
Journal: J Comput Aided Mol Des Date: 2000-02 Impact factor: 3.686

7. Fast prediction and visualization of protein binding pockets with PASS.

Authors: G P Brady; P F Stouten
Journal: J Comput Aided Mol Des Date: 2000-05 Impact factor: 3.686

8. Comparison of two implementations of the incremental construction algorithm in flexible docking of thrombin inhibitors.

Authors: R M Knegtel; D M Bayada; R A Engh; W von der Saal; V J van Geerestein; P D Grootenhuis
Journal: J Comput Aided Mol Des Date: 1999-03 Impact factor: 3.686

9. A comparative docking study and the design of potentially selective MMP inhibitors.

Authors: S Hanessian; N Moitessier; E Therrien
Journal: J Comput Aided Mol Des Date: 2001-10 Impact factor: 3.686

10. One site fits both: a model for the ternary complex of folate + NADPH in R67 dihydrofolate reductase, a D2 symmetric enzyme.

Authors: E E Howell; U Shukla; S N Hicks; R D Smiley; L A Kuhn; M I Zavodszky
Journal: J Comput Aided Mol Des Date: 2001-11 Impact factor: 3.686