pkgsrc/misc/molden/distinfo

$NetBSD: distinfo,v 1.6 2005/05/25 12:48:57 wiz Exp $

SHA1 (molden4.2.tar.Z) = 5377c6670b0ddc8317573a749494bac146d97a8b
RMD160 (molden4.2.tar.Z) = 05b4ebfbe2795a5d9832512a9ffc3004ea6b76cd
Size (molden4.2.tar.Z) = 3306529 bytes
SHA1 (patch-aa) = 62168b37335cc74737c2d967234c0e846ab7bfa3
Add RMD160 checksum. 2005-05-25 14:48:57 +02:00			$NetBSD: distinfo,v 1.6 2005/05/25 12:48:57 wiz Exp $
Initial import of molden-3.7 to the NetBSD packages collection. MOLDEN is a package for displaying molecular density. It is tuned to the Ab Initio packages GAMESS* and GAUSSIAN. It can read all the information it needs from a GAMESS or GAUSSIAN outputfile. In this form it has been running on a CONVEX C-120, an APOLLO DN10000, an IRIS 4D/70GT, a DECSTATION 5000 and a SUN, and in slightly adapted versions on a VAX and a CRAY-YMP. It should run smoothly on most Unix machines. See section INSTALLATION GUIDE on how to install MOLDEN. (* The GAMESS version referred to here is the european version maintaned by M.F. Guest et al not to be confused with the american version maintained by M.W. Schmidt et al) This package was provided by Osamu OISHI and modified slightly by me. 2002-05-31 21:15:48 +02:00
Update molden to 4.2. Patch provided by Osamu OISHI, the MAINTAINER. Changes since 4.0: - Corrected a few fortran syntax errors, thnx to Gyepes R. - on some platforms molden would not write a z-matrix, after stating that it just did. fixed. - radical changes in the way proteins can be manipulated with the z-matrix editor - The zmatrix conversion for proteins containing nucleotides has been improved, it will now create a zmatrix. - The windows version of molden now start the opengl helper program mogl, when you click a *.ogl file in the read file window. - Now when you apply the tinker amber force, automatically the charges associated with the atoms belonging to amino acid residues are set. - Added interactive docking. - More bug fixes and improvements. 2004-11-30 04:41:54 +01:00			`SHA1 (molden4.2.tar.Z) = 5377c6670b0ddc8317573a749494bac146d97a8b`
Add RMD160 checksum. 2005-05-25 14:48:57 +02:00			`RMD160 (molden4.2.tar.Z) = 05b4ebfbe2795a5d9832512a9ffc3004ea6b76cd`
Update molden to 4.2. Patch provided by Osamu OISHI, the MAINTAINER. Changes since 4.0: - Corrected a few fortran syntax errors, thnx to Gyepes R. - on some platforms molden would not write a z-matrix, after stating that it just did. fixed. - radical changes in the way proteins can be manipulated with the z-matrix editor - The zmatrix conversion for proteins containing nucleotides has been improved, it will now create a zmatrix. - The windows version of molden now start the opengl helper program mogl, when you click a *.ogl file in the read file window. - Now when you apply the tinker amber force, automatically the charges associated with the atoms belonging to amino acid residues are set. - Added interactive docking. - More bug fixes and improvements. 2004-11-30 04:41:54 +01:00			`Size (molden4.2.tar.Z) = 3306529 bytes`
Initial import of molden-3.7 to the NetBSD packages collection. MOLDEN is a package for displaying molecular density. It is tuned to the Ab Initio packages GAMESS* and GAUSSIAN. It can read all the information it needs from a GAMESS or GAUSSIAN outputfile. In this form it has been running on a CONVEX C-120, an APOLLO DN10000, an IRIS 4D/70GT, a DECSTATION 5000 and a SUN, and in slightly adapted versions on a VAX and a CRAY-YMP. It should run smoothly on most Unix machines. See section INSTALLATION GUIDE on how to install MOLDEN. (* The GAMESS version referred to here is the european version maintaned by M.F. Guest et al not to be confused with the american version maintained by M.W. Schmidt et al) This package was provided by Osamu OISHI and modified slightly by me. 2002-05-31 21:15:48 +02:00			`SHA1 (patch-aa) = 62168b37335cc74737c2d967234c0e846ab7bfa3`