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Digital Discovery
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February 27, 2026
Precision fragment addition: domain-specific DeepFrag2 models for smarter lead optimization
César R García-Jacas, Harrison Green, Shayne D Wierbowski, et al.
Current Opinion in Structural Biology
|
March 27, 2014
Computational approaches to mapping allosteric pathways
Victoria A Feher, Jacob D Durrant, Adam T Van Wart, et al.
Journal of Medicinal Chemistry
|
June 10, 2010
Computer-aided identification of Trypanosoma brucei uridine diphosphate galactose 4'-epimerase inhibitors: toward the development of novel therapies for African sleeping sickness
Jacob D Durrant, Michael D Urbaniak, Michael A J Ferguson, et al.
G3 (Bethesda, Md.)
|
July 2, 2020
MutantHuntWGS: A Pipeline for Identifying <i>Saccharomyces cerevisiae</i> Mutations
Mitchell A Ellison, Jennifer L Walker, Patrick J Ropp, et al.
Plos Neglected Tropical Diseases
|
September 3, 2010
Novel naphthalene-based inhibitors of Trypanosoma brucei RNA editing ligase 1
Jacob D Durrant, Laurence Hall, Robert V Swift, et al.
Bioorganic & Medicinal Chemistry
|
October 7, 2014
Celastrol inhibits Plasmodium falciparum enoyl-acyl carrier protein reductase
Lorillee C Tallorin, Jacob D Durrant, Quynh G Nguyen, et al.
Comparative Biochemistry and Physiology. Part B, Biochemistry & Molecular Biology
|
February 11, 2024
Functional convergence in gastric lysozymes of foregut-fermenting rodents, ruminants, and primates is not attributed to convergent molecular evolution
Nick Barts, Roshni H Bhatt, Chelsea Toner, et al.
ACS Central Science
|
March 4, 2020
Mesoscale All-Atom Influenza Virus Simulations Suggest New Substrate Binding Mechanism
Jacob D Durrant, Sarah E Kochanek, Lorenzo Casalino, et al.
Chemical Biology & Drug Design
|
May 23, 2012
Novel cruzain inhibitors for the treatment of Chagas' disease
Kathleen E Rogers, Henrik Keränen, Jacob D Durrant, et al.
Chemical Biology & Drug Design
|
April 29, 2017
Documenting and harnessing the biological potential of molecules in Distributed Drug Discovery (D3) virtual catalogs
Milata M Abraham, Ryan E Denton, Richard W Harper, et al.
Page
of 8
Search research articles
Search
Showing results (51-60 of 80) with videos related to
Sort By:
Page
of 8
Digital Discovery
|
February 27, 2026
Precision fragment addition: domain-specific DeepFrag2 models for smarter lead optimization
César R García-Jacas, Harrison Green, Shayne D Wierbowski, et al.
Current Opinion in Structural Biology
|
March 27, 2014
Computational approaches to mapping allosteric pathways
Victoria A Feher, Jacob D Durrant, Adam T Van Wart, et al.
Journal of Medicinal Chemistry
|
June 10, 2010
Computer-aided identification of Trypanosoma brucei uridine diphosphate galactose 4'-epimerase inhibitors: toward the development of novel therapies for African sleeping sickness
Jacob D Durrant, Michael D Urbaniak, Michael A J Ferguson, et al.
G3 (Bethesda, Md.)
|
July 2, 2020
MutantHuntWGS: A Pipeline for Identifying <i>Saccharomyces cerevisiae</i> Mutations
Mitchell A Ellison, Jennifer L Walker, Patrick J Ropp, et al.
Plos Neglected Tropical Diseases
|
September 3, 2010
Novel naphthalene-based inhibitors of Trypanosoma brucei RNA editing ligase 1
Jacob D Durrant, Laurence Hall, Robert V Swift, et al.
Bioorganic & Medicinal Chemistry
|
October 7, 2014
Celastrol inhibits Plasmodium falciparum enoyl-acyl carrier protein reductase
Lorillee C Tallorin, Jacob D Durrant, Quynh G Nguyen, et al.
Comparative Biochemistry and Physiology. Part B, Biochemistry & Molecular Biology
|
February 11, 2024
Functional convergence in gastric lysozymes of foregut-fermenting rodents, ruminants, and primates is not attributed to convergent molecular evolution
Nick Barts, Roshni H Bhatt, Chelsea Toner, et al.
ACS Central Science
|
March 4, 2020
Mesoscale All-Atom Influenza Virus Simulations Suggest New Substrate Binding Mechanism
Jacob D Durrant, Sarah E Kochanek, Lorenzo Casalino, et al.
Chemical Biology & Drug Design
|
May 23, 2012
Novel cruzain inhibitors for the treatment of Chagas' disease
Kathleen E Rogers, Henrik Keränen, Jacob D Durrant, et al.
Chemical Biology & Drug Design
|
April 29, 2017
Documenting and harnessing the biological potential of molecules in Distributed Drug Discovery (D3) virtual catalogs
Milata M Abraham, Ryan E Denton, Richard W Harper, et al.
Page
of 8