accsc

Pinned Repositories

ALFA
ALFA - Automatic Ligand Flexibility Assignment
Language:C++3 2 02
AZOrange
AstraZeneca add-ons to Orange.
Language:Python0 2 00
beto
BETO - Spanish version of the BERT model
0 1 00
biocma
Consensus Multiple Alignment format, using Biopython classes.
Language:Pawn0 1 00
BIOSEA
Language:C2 2 00
cGRILL
A simple affinity map generator written in C
Language:C00
cMMISMSA
An implementation of Classical Molecular Mechanics Implicit Solvation Model Surface Area (cMMISMSA)
Language:C1 2 00
CROCK
A very simple clone for Gaussian superimposition (ROCS-like)
Language:Objective-C4 2 03
GAsol
Genetic algorithm to convert 3D-RISM solvent densities to explicit water molecules in binding pockets
Language:C9 3 05
WATsite
Language:Python8 2 11

accsc's Repositories

accsc/GAsol
Genetic algorithm to convert 3D-RISM solvent densities to explicit water molecules in binding pockets
Language:C9 3 05
accsc/WATsite
Language:Python8 2 11
accsc/CROCK
A very simple clone for Gaussian superimposition (ROCS-like)
Language:Objective-C4 2 03
accsc/ALFA
ALFA - Automatic Ligand Flexibility Assignment
Language:C++3 2 02
accsc/BIOSEA
Language:C2 2 00
accsc/cMMISMSA
An implementation of Classical Molecular Mechanics Implicit Solvation Model Surface Area (cMMISMSA)
Language:C1 2 00
accsc/AZOrange
AstraZeneca add-ons to Orange.
Language:Python0 2 00
accsc/beto
BETO - Spanish version of the BERT model
0 1 00
accsc/biocma
Consensus Multiple Alignment format, using Biopython classes.
Language:Pawn0 1 00
accsc/cGRILL
A simple affinity map generator written in C
Language:C00
accsc/clever
A framework for 3D molecular fields calculations
Language:Python0 2 00
accsc/COMBINE
Comparative Binding Energy
Language:Fortran2 02
accsc/crpkinetics
2 0
accsc/fragment-protocol
2 0
accsc/gips
Development and Distribution of Gips - Building Models for Solvation Thermodynamics
Language:Python1 0
accsc/HTS_GA
Genetic algorithm to design an optimal HTS fingerprint
2 0
accsc/kinconform
Machine learning approach to classifying kinase crystal structure conformations (fixed for new MDAnalysis API)
Language:OpenEdge ABL2 0
accsc/mmpdb
A package to identify matched molecular pairs and use them to predict property changes.
Language:Python2 0
accsc/mutinf
Residue mutual information for MD simulations
Language:Python1 0
accsc/pyiunstir
NLP framework for the Iberian language
Language:Jupyter Notebook2 5
accsc/rt-dumper
Tool for dumping ticket history with attachments from Best Practical RT
Language:Python2 0
accsc/webeda
Web Based Exploratory Data Analysis app platform. Create responsive visualizations, data analysis, data processing, and PPT and Jupyter exports.
Language:Python1 0