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Missing pka file for some of the residues of a PDB file

Status: Open.

#440 In Electrostatics/pdb2pqr;

· negSA1 opened on Jun 20, 2025

Implementing amide bond types

Status: Open.

#438 In Electrostatics/pdb2pqr;

· ljmartin opened on Jun 16, 2025

NME (Cterm animation) is not recognized

Status: Open.

#437 In Electrostatics/pdb2pqr;

· kecherry opened on Jun 13, 2025

Wrong placement of HG in Leucine residues

Status: Open.

#436 In Electrostatics/pdb2pqr;

· jnoske opened on Jun 12, 2025

Porting the phosphorylated SER residues into the PDB2PQR web server

Status: Open.

#434 In Electrostatics/pdb2pqr;

· satyajitkhatua09 opened on Apr 14, 2025

pqr generation for lipids

Status: Open.

#433 In Electrostatics/pdb2pqr;

· amarkrishna47 opened on Apr 13, 2025

Is docutils really a dependency?

Status: Open.

#432 In Electrostatics/pdb2pqr;

· stefdoerr opened on Apr 4, 2025

C-Terminal amidation of Lysine keeps getting deleted.

Status: Open.

#431 In Electrostatics/pdb2pqr;

· Rutyruts opened on Apr 3, 2025

Error on charge computation for Residue ACE A 0 in Protein 1U19

Status: Open.

#428 In Electrostatics/pdb2pqr;

· yaideltg opened on Feb 20, 2025

No .pqr file ouput generated [PDB2PQR]

Status: Open.

#426 In Electrostatics/pdb2pqr;

· meowboon opened on Jan 19, 2025

Problem with whitespace in PQR file

Status: Open.

#425 In Electrostatics/pdb2pqr;

· sobolevnrm opened on Jan 11, 2025

Update build system to fail more quickly

Status: Open.

#424 In Electrostatics/pdb2pqr;

· sobolevnrm opened on Dec 30, 2024