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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
BioSolveIT PoseView
32
BioSolveIT GmbH
PoseView automatically generates high-quality 2D structure-diagrams of protein-ligand complexes provided as 3D...
high-quality 2D
structure
-diagrams of protein...describing the 3D
structure
of protein molecule
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
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
MED-SuMo .Net GUI
3
MEDIT S.A.
WinGAMESS Oct 10 R3
3
Iowa State University
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
Pintar InterACTIVE VirtuaLab Molecule Lite Version
free
InterWorld Highway, LLC
Pintar InterACTIVE VirtuaLab Molecule Lite Version allows you to look...
discover the various possible
structures
arising
NMRPrediction
PortaNova
UpSol NMRPrediction provides the chemist with the automatic prediction of 13C NMR and 1H...
Molecule Editor). Draw your
structure
of interest with JUME
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