StripHPDB.c File Reference

#include <stdlib.h>
#include "pdb.h"
#include "macros.h"

Go to the source code of this file.

Functions
PDB *	blStripHPDBAsCopy (PDB *pdbin, int *natom)

Detailed Description

Version

V1.10

Date

19.04.15

Copyright

(c) UCL / Dr. Andrew C. R. Martin, University of Reading, 2002-2015

Author

Dr. Andrew C. R. Martin

Institute of Structural & Molecular Biology, University College London, Gower Street, London. WC1E 6BT.

andre.nosp@m.w@bi.nosp@m.oinf..nosp@m.org..nosp@m.uk andre.nosp@m.w.ma.nosp@m.rtin@.nosp@m.ucl..nosp@m.ac.uk

This code is NOT IN THE PUBLIC DOMAIN, but it may be copied according to the conditions laid out in the accompanying file COPYING.DOC.

The code may be modified as required, but any modifications must be documented so that the person responsible can be identified.

The code may not be sold commercially or included as part of a commercial product except as described in the file COPYING.DOC.

Description:

Usage:

Revision History:

• V1.0 01.03.90 Original By: ACRM
• V1.1 28.03.90 Modified to match new version of pdb.h
• V1.2 24.05.90 Fixed so the variables passed in as sel[] don't have* to be 4 chars.
• V1.3 17.05.93 Modified for book. Returns BOOL.
• V1.4 09.07.93 Modified to return PDB pointer. Changed allocation scheme. Changed back to sel[] variables must be 4 chars.
• V1.5 01.11.94 Added HStripPDB()
• V1.6 26.07.95 Removed unused variables
• V1.7 16.10.96 Added SelectCaPDB()
• V1.8 07.07.14 Use bl prefix for functions By: CTP
• V1.9 19.08.14 Renamed blStripHPDBAsCopy() to blStripHPDBAsCopy() By: CTP
• V1.10 19.04.15 Added call to blCopyConects() By: ACRM

Definition in file StripHPDB.c.

Function Documentation

PDB* blStripHPDBAsCopy	(	PDB *	pdbin,
		int *	natom
	)

Parameters

[in]	*pdbin	Input list
[out]	*natom	Number of atoms kept

Returns

Output list

Take a PDB linked list and returns the PDB list minus hydrogens

N.B. The routine is non-destructive; i.e. the original PDB linked list is intact after the selection process

• 01.11.94 Original based on SelAtomsPDB() By: ACRM
• 26.07.95 Removed unused variables
• 07.07.14 Use bl prefix for functions By: CTP
• 19.08.14 Renamed function to blStripHPDBAsCopy() By: CTP
• 19.04.15 Added call to blCopyConect() By: ACRM

Definition at line 115 of file StripHPDB.c.