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Molecular Structures
Software
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SYBYL-X
268
Tripos
SYBYL-X is a program that enables you to find new lead candidates, optimize lead series or perform...
experiments like modeling a protein
structure
. The program has capabilities
Atomistix ToolKit
88
QuantumWise A/S
Atomistix ToolKit is a general-purpose atomic-scale modeling platform...
structure
and transport problems, or perform
molecular
...verifying advanced
structures
Chemistry 4D
70
CBIS - Chemical and Biological Information Systems
Chemistry 4-D Draw is a next-generation chemistry program combining...
create high-quality
structures
simply by entering
molecular
names
CambridgeSoft ChemBioOffice Ultra 2008
68
CambridgeSoft Corporation
TEST421
free
67
United States Environmental Protection Agency
TEST allows a user to estimate toxicity without requiring any external programs...
using Quantitative
Structure
Activity Relationships...
structure
of chemicals (known as
molecular
BALLView
free
50
Plone Foundation
BALLView is a free molecular modeling and molecular graphics tool...
OpenGL-based visualization of
molecular
structures
,
molecular
mechanics methods (minimization
Scigress
38
Fujitsu
SCIGRESS is a multiplatform molecular design, modeling and dynamics software suite designed with experimental...
A suite of
molecular
builders and visualization...to build novel
structures
in minutes. Calculations
AxPyMOL
28
DeLano Scientific LLC
AxPyMOL, a plugin for Windows PowerPoint that enables presentation of 3...
presentation of 3-D
molecular
data without having...PowerPoint to display
structures
using multiple
MIFit
free
19
Rigaku
MIFit is a cross-platform interactive graphics application for molecular modeling...
molecular
modeling, fitting, and refinement of protein
structures
...multiple
structures
and maps
COSMOview
free
17
COSMOlogic GmbH & Co. KG
COSMOview features: - open general formats xyz, sdf, ml2, pdb (only 3D structure...
COSMOview is a
molecular
3D
structure
...ml2, pdb (only 3D
structure
) - open TURBOMOLE coord
QikProp
13
Schrodinger LLC
QikProp is a program that efficiently evaluates pharmaceutically relevant properties...
QikProp is a program that efficiently evaluates pharmaceutically relevant properties
Visualization of the Resonance Graphs
free
11
Igor Pesek & Aleksander Vesel
This is a program for visualization of the resonance graphs of benzenoid graphs...
of the related conceptual
structures
is a crucial
ATOMS61
7
Shape Software
ATOMS is a program for drawing all types of atomic structures, including crystals...
all types of atomic
structures
, including crystals, polymers
HYDROpro
free
6
A. Ortega, D. Amorós, J. Garc1a de la Torre
HYDROPRO computes the hydrodynamic properties of rigid macromolecules (globular proteins...
) from their atomic-level
structure
, as specified
Ritmol
free
6
NUI, Galway
Ionic and covalent organic crystal structure prediction...
organic crystal
structure
prediction...tutorials covering
Molecular
Modelling
ACD Labs ChemSketch
5
ACD Labs
PyMOL Evaluation (32 bit)
3
DeLano Scientific LLC
ilib diverse
2
Inte:Ligand GmbH
Compounds are built by combining user-defined fragments according to state-of-the-art chemical knowledge...
approach providing good
structural
...guarantee good
structural
Rnaviz
free
2
Peter De Rijk
RnaViz is a user-friendly, portable, GUI program for producing publication...
publication-quality secondary
structure
drawings...a properly positioned
structure
drawing can
Perfect Science Icons
Aha-soft
Create a great scientific software faster with this set of scientific icons...
Retort, Test Probe, Molecule,
Structure
, numerous mathematical symbols, Chemical
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Tags
Molecular
Drawing
Molecular viewer
Molecular structure
Software
Program
Structure
Chemistry
Modeling
Proteins
