##ProbabilisticApproach
Theoretical advances have led to a procedure for automatic solution of macromolecular structures with up to ~6000 non-H atoms in the ASU, resolutions up to 2.3 Å and heavy atoms in the unit cell #DirectMethods #PattersonMap #ProbabilisticApproach doi.org/10.1107/S205...
August 27, 2026 at 2:02 PM
Carmelo Giacovazzo: Updating direct methods III. Reduction of structural complexity when first-rank semi-invariants are estimated via the Patterson map ##Phasing##Seminvariants##ProbabilisticApproach... ##IUCrhttps://journals.iucr.org/paper?S2053273325003274
Updating direct methods III. Reduction of structural complexity when first-rank semi-invariants are estimated via the Patterson map
A novel theory for the one-phase semi-invariant estimates is presented. The theoretical approach uses the Patterson map as prior information.
journals.iucr.org
May 23, 2025 at 12:00 AM
Is it possible to create a program that automatically leads from experimental data to phases of a sufficiently high quality that automatic model-building programs can end with accurate molecular models? #DirectMethods #PattersonMap #ProbabilisticApproach doi.org/10.1107/S205...
May 18, 2026 at 3:05 PM
M​aria Cristina Burla et al.: Updating direct methods V. Phasing when triplet invariants are estimated via the Patterson map ##DirectMethods##PattersonMap##ProbabilisticApproach... ##IUCrhttps://journals.iucr.org/paper?S2059798326000732
Updating direct methods V. Phasing when triplet invariants are estimated via the Patterson map
Crystal structures of proteins and nucleic acids with data resolution up to 2.2 Å are solved via a novel direct-methods program using the Pattterson map as prior information.
journals.iucr.org
February 10, 2026 at 1:00 AM
A novel theory for the one-phase semi-invariant estimates is presented. The theoretical approach uses the Patterson map as prior information.
https://ow.ly/HC1j50Y4gqW
Acta Cryst A IUCrJ #Phasing #Seminvariants #ProbabilisticApproach
February 5, 2026 at 2:35 PM
A novel theory for the one-phase semi-invariant estimates is presented. The theoretical approach uses the Patterson map as prior information.

https://ow.ly/qMkG50Y4w6G

Acta Cryst A
IUCrJ
#Phasing #Seminvariants #ProbabilisticApproach
February 5, 2026 at 2:35 PM