Investigating Drug-Target Residence Time in Kinases through Enhanced Sampling Simulations. (Record no. 29843059)
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| 000 -LEADER | |
|---|---|
| fixed length control field | 01518 a2200433 4500 |
| 005 - DATE AND TIME OF LATEST TRANSACTION | |
| control field | 20250518045323.0 |
| 008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION | |
| fixed length control field | 201908s 0 0 eng d |
| 022 ## - INTERNATIONAL STANDARD SERIAL NUMBER | |
| International Standard Serial Number | 1549-9626 |
| 024 7# - OTHER STANDARD IDENTIFIER | |
| Standard number or code | 10.1021/acs.jctc.9b00104 |
| Source of number or code | doi |
| 040 ## - CATALOGING SOURCE | |
| Original cataloging agency | NLM |
| Language of cataloging | eng |
| Transcribing agency | NLM |
| 100 1# - MAIN ENTRY--PERSONAL NAME | |
| Personal name | Gobbo, Dorothea |
| 264 #0 - PRODUCTION, PUBLICATION, DISTRIBUTION, MANUFACTURE, AND COPYRIGHT NOTICE | |
| Date of production, publication, distribution, manufacture, or copyright notice | 20190823 |
| 245 00 - TITLE STATEMENT | |
| Title | Investigating Drug-Target Residence Time in Kinases through Enhanced Sampling Simulations. |
| Medium | [electronic resource] |
| 260 ## - PUBLICATION, DISTRIBUTION, ETC. | |
| Name of publisher, distributor, etc. | Journal of chemical theory and computation |
| Date of publication, distribution, etc. | Aug 2019 |
| 300 ## - PHYSICAL DESCRIPTION | |
| Extent | 4646-4659 p. |
| Other physical details | digital |
| 500 ## - GENERAL NOTE | |
| General note | Publication Type: Journal Article |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Crystallography, X-Ray |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Glycogen Synthase Kinase 3 beta |
| General subdivision | antagonists & inhibitors |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Humans |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Kinetics |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Ligands |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Molecular Docking Simulation |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Molecular Dynamics Simulation |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Protein Binding |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Protein Kinase Inhibitors |
| General subdivision | chemistry |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Static Electricity |
| 650 04 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Thermodynamics |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Piretti, Valentina |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Di Martino, Rita Maria Concetta |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Tripathi, Shailesh Kumar |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Giabbai, Barbara |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Storici, Paola |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Demitri, Nicola |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Girotto, Stefania |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Decherchi, Sergio |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Cavalli, Andrea |
| 773 0# - HOST ITEM ENTRY | |
| Title | Journal of chemical theory and computation |
| Related parts | vol. 15 |
| -- | no. 8 |
| -- | p. 4646-4659 |
| 856 40 - ELECTRONIC LOCATION AND ACCESS | |
| Uniform Resource Identifier | <a href="https://doi.org/10.1021/acs.jctc.9b00104">https://doi.org/10.1021/acs.jctc.9b00104</a> |
| Public note | Available from publisher's website |
No items available.