BioExcel CoE
@bioexcelcoe.bsky.social
Centre of Excellence for Computational Biomolecular Research
Pinned
If you are an early-stage career scientist π§βπ¬ using biomolecular simulations the BioExcel Summer School is for you!
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
If you are an early-stage career scientist π§βπ¬ using biomolecular simulations the BioExcel Summer School is for you!
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
January 14, 2026 at 8:54 AM
If you are an early-stage career scientist π§βπ¬ using biomolecular simulations the BioExcel Summer School is for you!
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
Running since 2018 it always receives outstanding reviews
Apply here β‘οΈ bioexcel.eu/4ooy
Deadline for applications: 1st February!
#training #molecularsimulations #community
Join us for our #webinar where @matthieumontes.bsky.social will introduce the high-performance molecular-visualization and simulation platform VTX for rapid exploration of massive molecular systems
ποΈ 27 January 2026, 15:00 CET
βοΈ bioexcel.eu/bcjz
#moleculardynamics #molecularmodeling #visualization
ποΈ 27 January 2026, 15:00 CET
βοΈ bioexcel.eu/bcjz
#moleculardynamics #molecularmodeling #visualization
January 13, 2026 at 12:30 PM
Join us for our #webinar where @matthieumontes.bsky.social will introduce the high-performance molecular-visualization and simulation platform VTX for rapid exploration of massive molecular systems
ποΈ 27 January 2026, 15:00 CET
βοΈ bioexcel.eu/bcjz
#moleculardynamics #molecularmodeling #visualization
ποΈ 27 January 2026, 15:00 CET
βοΈ bioexcel.eu/bcjz
#moleculardynamics #molecularmodeling #visualization
Join us next week for our #webinar on "Mastering the Accelerated Weight Histogram method"
ποΈ 20 January 2026, 15:00 CET
βοΈ bioexcel.eu/5t76
We'll present 2 new tutorials covering AWH implementation in #GROMACS
Suitable for novice and advanced users
#moleculardynamics #enhancedsampling
ποΈ 20 January 2026, 15:00 CET
βοΈ bioexcel.eu/5t76
We'll present 2 new tutorials covering AWH implementation in #GROMACS
Suitable for novice and advanced users
#moleculardynamics #enhancedsampling
Webinar: Mastering the Accelerated Weight Histogram Method: from Principles to Practice (2026-01-20)
Date: 20 January 2026
Time: 15:00 CET
Registration
Abstract
The Accelerated Weight Histogram method (AWH) is an enhanced sampling technique for molecular dynamics simulations, capable of speeding up ...
bioexcel.eu
January 12, 2026 at 10:14 AM
Join us next week for our #webinar on "Mastering the Accelerated Weight Histogram method"
ποΈ 20 January 2026, 15:00 CET
βοΈ bioexcel.eu/5t76
We'll present 2 new tutorials covering AWH implementation in #GROMACS
Suitable for novice and advanced users
#moleculardynamics #enhancedsampling
ποΈ 20 January 2026, 15:00 CET
βοΈ bioexcel.eu/5t76
We'll present 2 new tutorials covering AWH implementation in #GROMACS
Suitable for novice and advanced users
#moleculardynamics #enhancedsampling
π’ Registration for the 2026 Computational Chemistry Spring School is open!
Theory, hands-on exercises on supercomputer GPUs, poster session and networking
ποΈ 8-10 April 2026
π Espoo, Finland
βΉοΈ bioexcel.eu/qrhx
#compchem #moleculardynamics #quantumchemistry
Theory, hands-on exercises on supercomputer GPUs, poster session and networking
ποΈ 8-10 April 2026
π Espoo, Finland
βΉοΈ bioexcel.eu/qrhx
#compchem #moleculardynamics #quantumchemistry
Spring School in Computational Chemistry 2026
Registration for the Spring School in Computational Chemistry 2026 is open
Date: 8 β 10 April 2026
Venue: CSC - IT Center for Science, Espoo, Finland
Registration fee: EUR 225.90 (VAT included)
Regis...
bioexcel.eu
January 7, 2026 at 8:38 AM
π’ Registration for the 2026 Computational Chemistry Spring School is open!
Theory, hands-on exercises on supercomputer GPUs, poster session and networking
ποΈ 8-10 April 2026
π Espoo, Finland
βΉοΈ bioexcel.eu/qrhx
#compchem #moleculardynamics #quantumchemistry
Theory, hands-on exercises on supercomputer GPUs, poster session and networking
ποΈ 8-10 April 2026
π Espoo, Finland
βΉοΈ bioexcel.eu/qrhx
#compchem #moleculardynamics #quantumchemistry
Don't miss out!
The registration deadline for our Ambassador Program workshop in Slovenia has been extended until 20 December
β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
The registration deadline for our Ambassador Program workshop in Slovenia has been extended until 20 December
β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
BioExcel / EuroCC workshop in Slovenia
Registration for this event is open
Our fourth Ambassador Program workshop is jointly organised and supported by our colleagues at the National Competence Centres in Slovenia, Croatia and Italy. The ...
bioexcel.eu
December 9, 2025 at 12:42 PM
Don't miss out!
The registration deadline for our Ambassador Program workshop in Slovenia has been extended until 20 December
β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
The registration deadline for our Ambassador Program workshop in Slovenia has been extended until 20 December
β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
The recording of our #webinar on the #GROMACS tutorial suite is now available and you can ask any questions related to this via the forum until the 20 December
π¦bioexcel.eu/4m5m
#moleculardynamics
π¦bioexcel.eu/4m5m
#moleculardynamics
December 4, 2025 at 2:38 PM
The recording of our #webinar on the #GROMACS tutorial suite is now available and you can ask any questions related to this via the forum until the 20 December
π¦bioexcel.eu/4m5m
#moleculardynamics
π¦bioexcel.eu/4m5m
#moleculardynamics
Our next #webinar is all about making movies in Molywood π½οΈποΈ
Join us on 16 December 2025, 15:00 CET to learn more!
Registration β‘οΈ bioexcel.eu/zdsm
Join us on 16 December 2025, 15:00 CET to learn more!
Registration β‘οΈ bioexcel.eu/zdsm
December 3, 2025 at 11:50 AM
Our next #webinar is all about making movies in Molywood π½οΈποΈ
Join us on 16 December 2025, 15:00 CET to learn more!
Registration β‘οΈ bioexcel.eu/zdsm
Join us on 16 December 2025, 15:00 CET to learn more!
Registration β‘οΈ bioexcel.eu/zdsm
π Join us tomorrow at 15:00 CET (UTC+1) to hear about "The GROMACS tutorial suite: from basic to advanced applications"
Registration is still open: bioexcel.eu/4m5m
#webinar #moleculardynamics #GROMACS
Registration is still open: bioexcel.eu/4m5m
#webinar #moleculardynamics #GROMACS
December 1, 2025 at 1:07 PM
π Join us tomorrow at 15:00 CET (UTC+1) to hear about "The GROMACS tutorial suite: from basic to advanced applications"
Registration is still open: bioexcel.eu/4m5m
#webinar #moleculardynamics #GROMACS
Registration is still open: bioexcel.eu/4m5m
#webinar #moleculardynamics #GROMACS
βοΈ Don't forget to register for our #webinar on 2 December at 15:00 CET
Alessandra Villa will take you through "The GROMACS tutorial suite: from basic to advanced applications"
Register here: bioexcel.eu/4m5m
#moleculardynamics
Alessandra Villa will take you through "The GROMACS tutorial suite: from basic to advanced applications"
Register here: bioexcel.eu/4m5m
#moleculardynamics
November 27, 2025 at 1:09 PM
βοΈ Don't forget to register for our #webinar on 2 December at 15:00 CET
Alessandra Villa will take you through "The GROMACS tutorial suite: from basic to advanced applications"
Register here: bioexcel.eu/4m5m
#moleculardynamics
Alessandra Villa will take you through "The GROMACS tutorial suite: from basic to advanced applications"
Register here: bioexcel.eu/4m5m
#moleculardynamics
Our hands-on #training event for #PhD students and #postdocs wanting to learn #BioBB #HADDOCK and #PMX is taking place:
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
β‘οΈ bioexcel.eu/3c00 (registration closes 10 December)
@eurocc.bsky.social
NCC Slovenia NCC Italy NCC Croatia
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
β‘οΈ bioexcel.eu/3c00 (registration closes 10 December)
@eurocc.bsky.social
NCC Slovenia NCC Italy NCC Croatia
November 25, 2025 at 8:38 AM
Our hands-on #training event for #PhD students and #postdocs wanting to learn #BioBB #HADDOCK and #PMX is taking place:
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
β‘οΈ bioexcel.eu/3c00 (registration closes 10 December)
@eurocc.bsky.social
NCC Slovenia NCC Italy NCC Croatia
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
β‘οΈ bioexcel.eu/3c00 (registration closes 10 December)
@eurocc.bsky.social
NCC Slovenia NCC Italy NCC Croatia
If you are interested in making molecular movies join us for our #webinar
ποΈ 16 December 2025, 15:00 CET
βοΈ bioexcel.eu/zdsm
ποΈ 16 December 2025, 15:00 CET
βοΈ bioexcel.eu/zdsm
November 21, 2025 at 3:58 PM
If you are interested in making molecular movies join us for our #webinar
ποΈ 16 December 2025, 15:00 CET
βοΈ bioexcel.eu/zdsm
ποΈ 16 December 2025, 15:00 CET
βοΈ bioexcel.eu/zdsm
π₯ We have opened the registration for our Summer School on Biomolecular Simulations 2026!
Our flagship training event will take place 7-12 June 2026 in Sardinia, Italy πβ±οΈ
More information and how to apply β‘οΈbioexcel.eu/4ooy
#training #molecularsimulations #community
Our flagship training event will take place 7-12 June 2026 in Sardinia, Italy πβ±οΈ
More information and how to apply β‘οΈbioexcel.eu/4ooy
#training #molecularsimulations #community
November 14, 2025 at 10:09 AM
π₯ We have opened the registration for our Summer School on Biomolecular Simulations 2026!
Our flagship training event will take place 7-12 June 2026 in Sardinia, Italy πβ±οΈ
More information and how to apply β‘οΈbioexcel.eu/4ooy
#training #molecularsimulations #community
Our flagship training event will take place 7-12 June 2026 in Sardinia, Italy πβ±οΈ
More information and how to apply β‘οΈbioexcel.eu/4ooy
#training #molecularsimulations #community
Join us for our next #webinar where we will provide an overview of the #GROMACS Tutorials Suite
We will cover different methods and installation of all the necessary software requirements
ποΈ 2 December 2025, 15:00 CET
βοΈ bioexcel.eu/4m5m
#moleculardynamics #freeenergy #enhancedsampling
We will cover different methods and installation of all the necessary software requirements
ποΈ 2 December 2025, 15:00 CET
βοΈ bioexcel.eu/4m5m
#moleculardynamics #freeenergy #enhancedsampling
November 12, 2025 at 12:35 PM
Join us for our next #webinar where we will provide an overview of the #GROMACS Tutorials Suite
We will cover different methods and installation of all the necessary software requirements
ποΈ 2 December 2025, 15:00 CET
βοΈ bioexcel.eu/4m5m
#moleculardynamics #freeenergy #enhancedsampling
We will cover different methods and installation of all the necessary software requirements
ποΈ 2 December 2025, 15:00 CET
βοΈ bioexcel.eu/4m5m
#moleculardynamics #freeenergy #enhancedsampling
Save the dates!
The 3rd BioExcel Conference on Advances in Biomolecular Simulations is happening:
ποΈ 27-30 September 2026
π Brno, Czech Republic
βΉοΈ bioexcel.eu/hzr0
Registration opens: 19 January 2026
#moleculardynamics #freeenergy #drugdesign #ai #conference
The 3rd BioExcel Conference on Advances in Biomolecular Simulations is happening:
ποΈ 27-30 September 2026
π Brno, Czech Republic
βΉοΈ bioexcel.eu/hzr0
Registration opens: 19 January 2026
#moleculardynamics #freeenergy #drugdesign #ai #conference
November 10, 2025 at 3:21 PM
Save the dates!
The 3rd BioExcel Conference on Advances in Biomolecular Simulations is happening:
ποΈ 27-30 September 2026
π Brno, Czech Republic
βΉοΈ bioexcel.eu/hzr0
Registration opens: 19 January 2026
#moleculardynamics #freeenergy #drugdesign #ai #conference
The 3rd BioExcel Conference on Advances in Biomolecular Simulations is happening:
ποΈ 27-30 September 2026
π Brno, Czech Republic
βΉοΈ bioexcel.eu/hzr0
Registration opens: 19 January 2026
#moleculardynamics #freeenergy #drugdesign #ai #conference
π’ Our Ambassador Program Adriatic Edition workshop is open for registration β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
In collaboration with @euroccslovakia.bsky.social EuroCC Italy EuroCC Croatia
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
In collaboration with @euroccslovakia.bsky.social EuroCC Italy EuroCC Croatia
BioExcel / EuroCC workshop in Slovenia
Registration for this event is open
Our fourth Ambassador Program workshop is jointly organised and supported by our colleagues at the National Competence Centres in Slovenia, Croatia and Italy. The ...
bioexcel.eu
November 6, 2025 at 8:55 AM
π’ Our Ambassador Program Adriatic Edition workshop is open for registration β‘οΈ bioexcel.eu/3c00
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
In collaboration with @euroccslovakia.bsky.social EuroCC Italy EuroCC Croatia
Lectures and hands-on tutorials covering #BioBB #HADDOCK and #PMX
ποΈ 11-12 February 2026
π Ljubljana, Slovenia
In collaboration with @euroccslovakia.bsky.social EuroCC Italy EuroCC Croatia
π₯Hot off the press!
Assessing the performance of the GAFF2/ABCG2 parametrization in protein-ligand relative binding free-energy simulations using non-equilibrium alchemy.
Read to learn more β‘οΈ bit.ly/43aLrA9
@compbiophys.bsky.social
#molecular #simulation #drugdiscovery
Assessing the performance of the GAFF2/ABCG2 parametrization in protein-ligand relative binding free-energy simulations using non-equilibrium alchemy.
Read to learn more β‘οΈ bit.ly/43aLrA9
@compbiophys.bsky.social
#molecular #simulation #drugdiscovery
Evaluation of the ABCG2 Charge Model in ProteinβLigand Binding Free-Energy Calculations
Accurate binding free energy prediction is vital for drug design, motivating the assessment of new force field models. Here, we evaluate the ABCG2 charge model with nonequilibrium alchemical free-ener...
bit.ly
November 4, 2025 at 8:41 AM
π₯Hot off the press!
Assessing the performance of the GAFF2/ABCG2 parametrization in protein-ligand relative binding free-energy simulations using non-equilibrium alchemy.
Read to learn more β‘οΈ bit.ly/43aLrA9
@compbiophys.bsky.social
#molecular #simulation #drugdiscovery
Assessing the performance of the GAFF2/ABCG2 parametrization in protein-ligand relative binding free-energy simulations using non-equilibrium alchemy.
Read to learn more β‘οΈ bit.ly/43aLrA9
@compbiophys.bsky.social
#molecular #simulation #drugdiscovery
Reposted by BioExcel CoE
INTERNATIONAL SYMPOSIUM ON GRIDS & CLOUDS (ISG) 2026
15-20 March 2026, Academia Sinica, Taipei, Taiwan
CALL FOR ABSTRACT
There will also be a #HADDOCK @bioexcelcoe.bsky.social workshop in the context of the EU-INDIA GANANA project.
15-20 March 2026, Academia Sinica, Taipei, Taiwan
CALL FOR ABSTRACT
There will also be a #HADDOCK @bioexcelcoe.bsky.social workshop in the context of the EU-INDIA GANANA project.
October 9, 2025 at 9:37 AM
INTERNATIONAL SYMPOSIUM ON GRIDS & CLOUDS (ISG) 2026
15-20 March 2026, Academia Sinica, Taipei, Taiwan
CALL FOR ABSTRACT
There will also be a #HADDOCK @bioexcelcoe.bsky.social workshop in the context of the EU-INDIA GANANA project.
15-20 March 2026, Academia Sinica, Taipei, Taiwan
CALL FOR ABSTRACT
There will also be a #HADDOCK @bioexcelcoe.bsky.social workshop in the context of the EU-INDIA GANANA project.
Last chance to provide your feedback!
Our BioExcel 2025 survey is closing tomorrow, 31st October π
Please fill in the survey β‘οΈbit.ly/3Vi7HE1
Our BioExcel 2025 survey is closing tomorrow, 31st October π
Please fill in the survey β‘οΈbit.ly/3Vi7HE1
October 30, 2025 at 9:30 AM
Last chance to provide your feedback!
Our BioExcel 2025 survey is closing tomorrow, 31st October π
Please fill in the survey β‘οΈbit.ly/3Vi7HE1
Our BioExcel 2025 survey is closing tomorrow, 31st October π
Please fill in the survey β‘οΈbit.ly/3Vi7HE1
Our BioExcel 2025 survey is closing at the end of October β‘οΈbit.ly/3Vi7HE1
Please take this opportunity to provide us with your feedback!
Please take this opportunity to provide us with your feedback!
October 16, 2025 at 1:32 PM
Our BioExcel 2025 survey is closing at the end of October β‘οΈbit.ly/3Vi7HE1
Please take this opportunity to provide us with your feedback!
Please take this opportunity to provide us with your feedback!
Last chance to register βοΈ
Our special edition webinar featuring talks on #topoisomerase inhibition, transmembrane #signalling and #membrane multilamellarity is this afternoon at 15:00 CEST
Register here β‘οΈbioexcel.eu/ion8
Our special edition webinar featuring talks on #topoisomerase inhibition, transmembrane #signalling and #membrane multilamellarity is this afternoon at 15:00 CEST
Register here β‘οΈbioexcel.eu/ion8
September 23, 2025 at 8:00 AM
Last chance to register βοΈ
Our special edition webinar featuring talks on #topoisomerase inhibition, transmembrane #signalling and #membrane multilamellarity is this afternoon at 15:00 CEST
Register here β‘οΈbioexcel.eu/ion8
Our special edition webinar featuring talks on #topoisomerase inhibition, transmembrane #signalling and #membrane multilamellarity is this afternoon at 15:00 CEST
Register here β‘οΈbioexcel.eu/ion8
Happening next week!
Our 23-September, special edition webinar will feature talks on topoisomerase inhibition, transmembrane signalling and membrane multilamellarity
Register here β‘οΈbioexcel.eu/ion8
Our 23-September, special edition webinar will feature talks on topoisomerase inhibition, transmembrane signalling and membrane multilamellarity
Register here β‘οΈbioexcel.eu/ion8
September 17, 2025 at 11:53 AM
Happening next week!
Our 23-September, special edition webinar will feature talks on topoisomerase inhibition, transmembrane signalling and membrane multilamellarity
Register here β‘οΈbioexcel.eu/ion8
Our 23-September, special edition webinar will feature talks on topoisomerase inhibition, transmembrane signalling and membrane multilamellarity
Register here β‘οΈbioexcel.eu/ion8
5οΈβ£ Featuring the fifth of our showcase projects
Our automated pipeline, built on BioBBs, uses #AlphaFold, MD simulations, and virtual screening to output a list of ligand poses β‘οΈ bioexcel.eu/1c1j
#DrugDiscovery #Workflows #CADD #VirtualScreening
Our automated pipeline, built on BioBBs, uses #AlphaFold, MD simulations, and virtual screening to output a list of ligand poses β‘οΈ bioexcel.eu/1c1j
#DrugDiscovery #Workflows #CADD #VirtualScreening
September 12, 2025 at 3:17 PM
5οΈβ£ Featuring the fifth of our showcase projects
Our automated pipeline, built on BioBBs, uses #AlphaFold, MD simulations, and virtual screening to output a list of ligand poses β‘οΈ bioexcel.eu/1c1j
#DrugDiscovery #Workflows #CADD #VirtualScreening
Our automated pipeline, built on BioBBs, uses #AlphaFold, MD simulations, and virtual screening to output a list of ligand poses β‘οΈ bioexcel.eu/1c1j
#DrugDiscovery #Workflows #CADD #VirtualScreening
4οΈβ£ Featuring the fourth of our showcase projects
Upgrading GROMACS to handle billion-atom systems and enhancing I/O performance and precision, making the first-ever whole-cell simulation possible β‘οΈ bioexcel.eu/uw67
#MolecularDynamics #GROMACS #ComputationalBiology
Upgrading GROMACS to handle billion-atom systems and enhancing I/O performance and precision, making the first-ever whole-cell simulation possible β‘οΈ bioexcel.eu/uw67
#MolecularDynamics #GROMACS #ComputationalBiology
September 12, 2025 at 6:22 AM
4οΈβ£ Featuring the fourth of our showcase projects
Upgrading GROMACS to handle billion-atom systems and enhancing I/O performance and precision, making the first-ever whole-cell simulation possible β‘οΈ bioexcel.eu/uw67
#MolecularDynamics #GROMACS #ComputationalBiology
Upgrading GROMACS to handle billion-atom systems and enhancing I/O performance and precision, making the first-ever whole-cell simulation possible β‘οΈ bioexcel.eu/uw67
#MolecularDynamics #GROMACS #ComputationalBiology
3οΈβ£ Featuring the third of our showcase projects
We are tackling the tough-to-predict H3 antibody/nanobody loop using AlphaFlow and hierarchical clustering to create more accurate models β‘οΈbioexcel.eu/56jw
#Antibodies #AlphaFlow #DrugDiscovery
We are tackling the tough-to-predict H3 antibody/nanobody loop using AlphaFlow and hierarchical clustering to create more accurate models β‘οΈbioexcel.eu/56jw
#Antibodies #AlphaFlow #DrugDiscovery
September 11, 2025 at 1:18 PM
3οΈβ£ Featuring the third of our showcase projects
We are tackling the tough-to-predict H3 antibody/nanobody loop using AlphaFlow and hierarchical clustering to create more accurate models β‘οΈbioexcel.eu/56jw
#Antibodies #AlphaFlow #DrugDiscovery
We are tackling the tough-to-predict H3 antibody/nanobody loop using AlphaFlow and hierarchical clustering to create more accurate models β‘οΈbioexcel.eu/56jw
#Antibodies #AlphaFlow #DrugDiscovery
2β£ Featuring the second of our showcase projects
Through a combination of AlphaFold2 and other tools we are bypassing the limits of traditional MD simulations β‘οΈ bioexcel.eu/dvy3
#Proteins #MolecularDynamics #GROMACS #AlphaFold2
Through a combination of AlphaFold2 and other tools we are bypassing the limits of traditional MD simulations β‘οΈ bioexcel.eu/dvy3
#Proteins #MolecularDynamics #GROMACS #AlphaFold2
September 9, 2025 at 8:04 PM
2β£ Featuring the second of our showcase projects
Through a combination of AlphaFold2 and other tools we are bypassing the limits of traditional MD simulations β‘οΈ bioexcel.eu/dvy3
#Proteins #MolecularDynamics #GROMACS #AlphaFold2
Through a combination of AlphaFold2 and other tools we are bypassing the limits of traditional MD simulations β‘οΈ bioexcel.eu/dvy3
#Proteins #MolecularDynamics #GROMACS #AlphaFold2