RASPD+: Fast Protein-Ligand Binding Free Energy Prediction Using Simplified Physicochemical Features.
Saved in:
| Title: | RASPD+: Fast Protein-Ligand Binding Free Energy Prediction Using Simplified Physicochemical Features. |
|---|---|
| Authors: | Holderbach S; Molecular and Cellular Modelling Group, Heidelberg Institute of Theoretical Studies, Heidelberg, Germany.; Institute of Pharmacy and Molecular Biotechnology (IPMB), Heidelberg University, Heidelberg, Germany., Adam L; Molecular and Cellular Modelling Group, Heidelberg Institute of Theoretical Studies, Heidelberg, Germany.; Institute of Pharmacy and Molecular Biotechnology (IPMB), Heidelberg University, Heidelberg, Germany., Jayaram B; Supercomputing Facility for Bioinformatics & Computational Biology, Department of Chemistry, Kusuma School of Biological Sciences, Indian Institute of Technology Delhi, New Delhi, India., Wade RC; Molecular and Cellular Modelling Group, Heidelberg Institute of Theoretical Studies, Heidelberg, Germany.; Center for Molecular Biology (ZMBH), DKFZ-ZMBH Alliance, Heidelberg University, Heidelberg, Germany.; Interdisciplinary Center for Scientific Computing (IWR), Heidelberg University, Heidelberg, Germany., Mukherjee G; Molecular and Cellular Modelling Group, Heidelberg Institute of Theoretical Studies, Heidelberg, Germany.; Center for Molecular Biology (ZMBH), DKFZ-ZMBH Alliance, Heidelberg University, Heidelberg, Germany. |
| Source: | Frontiers in molecular biosciences [Front Mol Biosci] 2020 Dec 17; Vol. 7, pp. 601065. Date of Electronic Publication: 2020 Dec 17 (Print Publication: 2020). |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: Frontiers Media S.A Country of Publication: Switzerland NLM ID: 101653173 Publication Model: eCollection Cited Medium: Print ISSN: 2296-889X (Print) Linking ISSN: 2296889X NLM ISO Abbreviation: Front Mol Biosci Subsets: PubMed not MEDLINE |
| Database: | MEDLINE Ultimate |
Be the first to leave a comment!
