Multi-task generative topographic mapping in virtual screening.
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 331, doi. 10.1007/s10822-019-00188-x
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- Publication type:
- Article
Works matching IS 0920654X AND DT 2019 AND VI 33 AND IP 3
Results: 6
1
2
Water molecules in protein-ligand interfaces. Evaluation of software tools and SAR comparison.
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 307, doi. 10.1007/s10822-019-00187-y
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- Publication type:
- Article
3
Optimisation of human V<sub>H</sub> domain antibodies specific to Mycobacterium tuberculosis heat shock protein (HSP16.3).
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 375, doi. 10.1007/s10822-019-00186-z
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- Publication type:
- Article
4
Predicting protein-ligand binding modes for CELPP and GC3: workflows and insight.
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 367, doi. 10.1007/s10822-019-00185-0
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- Publication type:
- Article
5
Discovery and evaluation of novel Mycobacterium tuberculosis ketol-acid reductoisomerase inhibitors as therapeutic drug leads.
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 357, doi. 10.1007/s10822-019-00184-1
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- Publication type:
- Article
6
Uncovering abnormal changes in logP after fluorination using molecular dynamics simulations.
- Published in:
- Journal of Computer-Aided Molecular Design, 2019, v. 33, n. 3, p. 345, doi. 10.1007/s10822-018-0183-1
- By:
- Publication type:
- Article