Computational Molecular Biology At NIH
Structure
Protein Secondary Structure Prediction
QL
- Quadratic-Logistic prediction method, based on maximum-likelihood methods (NIH only)
QL With Homologs
- Quadratic-Logistic prediction method from multiple sequences (NIH only)
GOR-IV
- from the Garnier group (NIH only)
SAM-T02
- HMM-based, by Kevin Karplus as UCSC
PSIPRED
- Fast response, Based on neural networks and BLAST, at London's Global Univ.
nnPredict
- simple as simple can be, at UCSF
PredictProtein
- comprehensive sequence analysis and structure prediction
ProDom
- protein domain family database, at CNRS, France
Pfam
- multiple sequence alignments and hidden Markov models, The Sanger Institute
metaPrDOS
- meta Protein DisOrder prediction System, at Univ. of Tokyo
EMBOSS-Lite - pepwheel
- (equivalent to GCG Helicalwheel) at Helix Systems (NIH only)
Helical Wheel Applet
- at University of Virginia
OCTOPUS
- Prediction of membrane protein topology and signal peptides, at Stockholm University
Ab initio Protein Modelling
ROBETTA
- Full-chain Protein Structure Prediction Server, very slow queuing system
Comparative Protein Modelling
PROSPECT
- very fast parallelized version of PROSPECT v2.0, at Helix Systems (NIH only)
Swiss-Model
- an automated comparative protein modelling server, at ExPASy.org
SCRWL server
- builds homology models for molecular replacement, JCSG
M4T
- fully automatic comparative modelling, Yale University
GeneSilico Metaserver
- gateway to various protein structure prediction methods
BionInfoBank Meta Server
- gateway to structural and functional prediction
WURST
- Protein threading web server, at Univ. of Hamburg
Other Protein Modelling
FRpred
- Prediction of protein functional residues from sequence by probability density estimation, at MPIDB
BONGO
- Structural effect prediction of non-synonymous SNPs, at Univ. of Cambridge
Protein Quaternary Structure Prediction
ClusPro
- fully automatic protein-protein docking
NetworkBLAST
- find evolutionarily conserved protein interaction networks, at Tel Aviv Univ.
NetMHC 3.0
- Predicts binding of peptides to HLA alleles, at Tech. Univ. of Denmark
HADDOCK
- High Ambiguity Driven protein-protein DOCKing, at Univ. Utrecht
SmoothDock
- Docking, pure and simple, at Univ. of Pittsburgh
FireDock
- Refinement and re-scoring of protein-protein docking solutions, at Tel-Aviv University
Protein Structure Refinement and Analysis
CaspR
- automated molecular replacement server, CNRS
TB Consortium
- electron density map improvement server, Texas AM University
PoseViewWeb
- automatic 2D ligand complex diagrams, at Universität Hamburg
molmovdb.org
- Database of Macromolecular Movements with Associated Tools, at Yale
HingeProt
- Protein hinge prediction using elastic network models
IntAct
- database system and analysis tools for protein interaction data, at EBI
Fold Space Navigator
- Quantitative classification, efficient navigation, and instantaneous visualization of similarities, at University of Salzberg
ModFOLD
- Assessment of protein structure quality, at University of Reading
NQ-Flipper
- Flip those asparagines and glutamines!
ERIS
- Protein stability prediction server, at UNC
MOLEOnline
- Find and analyze molecuar channels, tunnels, and pores, at Univ. Palackeho
PROPKA2.0
- Fast calculation of protein PKas, at Univ. of Copenhagen
MolAxis
- Accurate Identification of Channels in Macromolecules, at Tel Aviv Univ.
Protein Structure Alignment
TOPOFIT-DB
- Database of structural alignments based on the TOPOFIT method
HOMSTRAD
- Homologous Structure Alignment Database, at University of Cambridge
Protein Blocks Expert
- Structural alignment using structural alphabets, at Université de La Réunion
Cathedral
- Find the closest protein fold group for a given structure, at CATH
PRIDE2
- Calculate probability of identity between structures, at ICGEB
TopMatch
- cool web-based structural alignment tool, requires IE and Jmol, at University of Salzberg