Канал: Science Aura

CHEM-INFORMATICS 02

CHEM-INFORMATICS 02

CHEM-INFORMATICS 01

CHEM-INFORMATICS 01

Molecular docking #4

Molecular docking #4

Molecular Docking #5

Molecular Docking #5

WINMOSTAR 03 - (POINT GROUP ANALYSIS)

WINMOSTAR 03 - (POINT GROUP ANALYSIS)

WebMO 04 - (Transition State of an SN2 Reaction)

WebMO 04 - (Transition State of an SN2 Reaction)

WebMO 01 - (Molecular Modelling)

WebMO 01 - (Molecular Modelling)

WINMOSTAR 02 - (Molecular Modelling & Editing)

WINMOSTAR 02 - (Molecular Modelling & Editing)

WebMO 03 - (Gaussian – Spectral Interpretation)

WebMO 03 - (Gaussian – Spectral Interpretation)

WINMOSTAR 05 - (UV-VIS SPECTRUM BY USING CNDO-d METHOD)

WINMOSTAR 05 - (UV-VIS SPECTRUM BY USING CNDO-d METHOD)

WebMO 05 - (HUCKEL MOLECULAR ORBITALS)

WebMO 05 - (HUCKEL MOLECULAR ORBITALS)

WebMO 02 - (GAUSSIAN BASIS SETS)

WebMO 02 - (GAUSSIAN BASIS SETS)

WINMOSTAR 06 - (Molecular Orbital Using CNDO-d Method)

WINMOSTAR 06 - (Molecular Orbital Using CNDO-d Method)

WINMOSTAR 04 - (Vibrational modes & Spectral Analysis)

WINMOSTAR 04 - (Vibrational modes & Spectral Analysis)

WINMOSTAR 07 - (CONCEPT OF Z - MATRIX)

WINMOSTAR 07 - (CONCEPT OF Z - MATRIX)

AVOGARO - Concept of Planarity in Molecules

AVOGARO - Concept of Planarity in Molecules

MOPAC 7 - (Calculations Using Hamiltonians Part 01)

MOPAC 7 - (Calculations Using Hamiltonians Part 01)

MOPAC 6 - (Calculations using Hamiltonian Part 02 )

MOPAC 6 - (Calculations using Hamiltonian Part 02 )

MoPAC 1 - Point Group Analysis

MoPAC 1 - Point Group Analysis

MoPAC 2 - Heat of Formation

MoPAC 2 - Heat of Formation

MoPAC 3 - Vibrational Parameters (Rotational Constants, ZPE, Modes of Vibrations)

MoPAC 3 - Vibrational Parameters (Rotational Constants, ZPE, Modes of Vibrations)

MoPAC 4 - Bond Order Calculations

MoPAC 4 - Bond Order Calculations

MoPAC 5 - Pka of an Acid

MoPAC 5 - Pka of an Acid

MOPAC 8 (HOMO LUMO ENERGIES)

MOPAC 8 (HOMO LUMO ENERGIES)

Winmostar v 10 01 - Installation

Winmostar v 10 01 - Installation

MOPAC installation

MOPAC installation

Molecular Docking #2

Molecular Docking #2

Molecular Docking #1

Molecular Docking #1

Molecular Docking #3

Molecular Docking #3

Plotly - Scientific graphing & Data analysis

Plotly - Scientific graphing & Data analysis

ORIGIN - 1

ORIGIN - 1

GAUSSIAN - 1 (Electrostatic potential maps)

GAUSSIAN - 1 (Electrostatic potential maps)

ONLINE WORKSHOP ON NUANCES IN COMPUTATIONAL CHEMISTRY

ONLINE WORKSHOP ON NUANCES IN COMPUTATIONAL CHEMISTRY

AVOGADRO - 1 (construct simple molecule)

AVOGADRO - 1 (construct simple molecule)

AVOGADRO - 3 (smiles & fragments)

AVOGADRO - 3 (smiles & fragments)

AVOGADRO - 2 (Importing from PDB)

AVOGADRO - 2 (Importing from PDB)

AVOGADRO -5 (Nucleic Acid)

AVOGADRO -5 (Nucleic Acid)

AVOGADRO - 8 (Optimizing Geometry)

AVOGADRO - 8 (Optimizing Geometry)

AVOGADRO - 7 (building material)

AVOGADRO - 7 (building material)

GAUSSIAN - Introduction

GAUSSIAN - Introduction

GAUSSIAN - 7 (TD DFT 1)

GAUSSIAN - 7 (TD DFT 1)

GAUSSIAN - 6 (UV spectra)

GAUSSIAN - 6 (UV spectra)

GAUSSIAN - 5 (NMR spectra)

GAUSSIAN - 5 (NMR spectra)

GAUSSIAN -4 (Molecular orbitals)

GAUSSIAN -4 (Molecular orbitals)

GAUSSIAN - 3 (Gauss View 06)

GAUSSIAN - 3 (Gauss View 06)

GAUSSIAN - 2 (Vibrational Analysis)

GAUSSIAN - 2 (Vibrational Analysis)

Introduction to computational chemistry

Introduction to computational chemistry

AVOGADRO Introduction

AVOGADRO Introduction

AVOGADRO - 4 (Peptide)

AVOGADRO - 4 (Peptide)

ORIGIN 2

ORIGIN 2

GAUSSIAN - 8 (TD DFT 2)

GAUSSIAN - 8 (TD DFT 2)