6 results on '"Ishchenko, Alexey"'
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2. SMoG: De novo design method based on simple, fast, and accurate free energy estimates. 2. Case studies in molecular design
3. Development of a knowledge-based potential for crystals of small organic molecules: calculation of energy surfaces for C=O...H-N hydrogen bonds
4. Structure-based design technology contour and its application to the design of renin inhibitors.
5. Discovery of VTP-27999, an Alkyl Amine Renin Inhibitor with Potential for Clinical Utility.
6. SMall Molecule Growth 2001 (SMoG2001): an improved knowledge-based scoring function for protein-ligand interactions.
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