29 Commits

Author	SHA1	Message	Date
Peter Schmidtke	9fdba19dd7	Merge pull request #154 from Discngine/issue-151 ... Bugfix of wrong atom_site parsing	2024-09-04 10:02:25 +02:00
Peter Schmidtke	4810330d32	fixes in molfile abi version	2024-07-23 15:01:04 +00:00
pschmidtke	c75e2d7f98	adding osx shared libraries	2024-07-23 10:00:35 +02:00
Peter Schmidtke	0e8b195945	issue-151 fix	2024-07-23 07:39:34 +00:00
Pegerto Fernandez	6c5db32fdd	compile M1/M2 chip molfile fork	2024-06-13 09:53:20 +01:00
pschmidtke	73e911ab58	issue-107 updating molfile plugin for linux 64 bit	2024-01-11 11:54:22 +01:00
pschmidtke	4f4893164f	issue-107 accepting long chain & ligand names, exit code handling & ref test output. Fixes on molfile plugin for cif reading	2024-01-11 11:38:03 +01:00
pschmidtke	cd00b961e6	adding linux built molfileplugin	2022-05-10 11:13:07 +02:00
pschmidtke	84967334d8	fixes on alternate locations in cif & output as cif	2022-05-10 10:58:46 +02:00
pschmidtke	71637e923f	update for osx	2021-11-17 16:21:03 +01:00
pschmidtke	127c60a49b	last fixes for cif support for models	2021-11-16 21:47:15 +01:00
pschmidtke	f99a6ed96d	pdbxpluging update	2021-11-15 21:46:24 +01:00
pschmidtke	855bad8cce	update molfilepluging linux & osx	2021-11-10 15:16:39 +01:00
pschmidtke	edfd87c188	support for OSX & residue selection on mmcif	2021-11-09 21:10:03 +01:00
pschmidtke	9a7a1d321c	shared library update OSX86_64	2020-07-30 11:34:06 +02:00
ShorkarMael	ae1f26089c	insertion code reading	2020-07-17 05:01:36 -07:00
ShorkarMael	fca9e379c5	longer chain names	2020-07-17 01:18:55 -07:00
ShorkarMael	3ef844937b	take into account 2 letters chain names	2020-07-16 11:31:45 -07:00
ShorkarMael	81618554df	updated pdbxplugin	2020-07-16 02:12:02 -07:00
ShorkarMael	62d1a12438	mmcif_reading works but outputs fatal error	2020-07-13 07:58:46 -07:00
ShorkarMael	e82a452044	molfile_plugin src modif	2020-07-08 15:46:15 -07:00
ShorkarMael	642bc8f12b	reading mmcif with read_mmcif.c	2020-07-03 02:47:32 -07:00
Peter Schmidtke	6159eab71f	updating shared mofile for osx 64bits	2019-05-26 23:04:52 +02:00
Peter Schmidtke	c9ed2e4768	adapted for gcc & clang compilations + OSX 64 bit	2019-05-25 14:22:17 +02:00
Peter Schmidtke	1a381a3815	new molfile plugin compilation	2019-05-25 02:20:23 +02:00
pschmidtke	963d9e3e69	merge desmond and master mess	2018-06-03 01:39:38 +02:00
pschmidtke	493d4a5b36	enabling DESRES DTR file format support for mdpocket	2018-04-24 23:33:30 +02:00
Peter Schmidtke	c847b6a151	with actual source code now hopefully	2017-03-23 08:58:57 +01:00
pschmidtke	346dadf58a	initial fpocket 3.0.4 commit	2017-03-22 23:31:13 +01:00