journal of molecular graphics & modelling

Rank: 43.02 /
Indexings
ncbi ulakbim MEP: 402 Ödeme: 2010 Yılı: 2019
Short Name j mol graph model
Abbreviated Name j mol graph model
ISSN 1873-4243
Aim and Scope
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Publications Per Year

Top 10 Most Clicked Articles

2019 Deogratias, Geradius, Seriani, Nicola, Pogrebnaya, Tatiana, Pogrebnoi, Alexander,

Tuning optoelectronic properties of triphenylamine based dyes through variation of pi-conjugated units and anchoring groups: A DFT/TD-DFT investigation. ,

94: 107480
Clicks: 401
2019 Karnati, Konda Reddy, Wang, Yixuan,

Structural and binding insights into HIV-1 protease and P2-ligand interactions through molecular dynamics simulations, binding free energy and principal component analysis. ,

92: 112-122
Clicks: 371
2019 Holtomo, Olivier, Nsangou, Mama, Fifen, Jean Jules, Motapon, Ousmanou,

Thermodynamic of solvation, solute - Solvent electron transfer and ionization potential of BSCAPE molecule and its UV-vis spectra in aqueous solution. ,

92: 100-111
Clicks: 345
2019 Saravanan, Kandasamy, Sivanandam, Magudeeswaran, Hunday, Govindasamy, Pavan, Mysore S, Kumaradhas, Poomani,

Exploring the different environments effect of piperine via combined crystallographic, QM/MM and molecular dynamics simulation study. ,

92: 280-295
Clicks: 344
2016 Mirza, Shaher Bano, Salmas, Ramin Ekhteiari, Fatmi, M Qaiser, Durdagi, Serdar,

Virtual screening of eighteen million compounds against dengue virus: Combined molecular docking and molecular dynamics simulations study. ,

66: 99-107
Clicks: 312
2007 Saen-oon, Suwipa, Aruksakunwong, Ornjira, Wittayanarakul, Kittiyaporn, Sompornpisut, Pornthep, Hannongbua, Supot,

Insight into analysis of interactions of saquinavir with HIV-1 protease in comparison between the wild-type and G48V and G48V/L90M mutants based on QM and QM/MM calculations. ,

26: 720-7
Clicks: 311
2019 Logdi, Ratan, Bag, Arijit, Tiwari, Ashwani K,

DFT based engineering of N-heterocyclic carbenes to exacerbate its activity for SO fixation and storage. ,

93: 107437
Clicks: 307
2019 Pasala, Chiranjeevi, Katari, Sudheer Kumar, Nalamolu, Ravina Madhulitha, Bitla, Aparna R, Amineni, Umamaheswari,

In silico probing exercises, bioactive-conformational and dynamic simulations strategies for designing and promoting selective therapeutics against Helicobacter pylori strains. ,

92: 167-179
Clicks: 306
2019 Nutho, Bodee, Rungrotmongkol, Thanyada,

Binding recognition of substrates in NS2B/NS3 serine protease of Zika virus revealed by molecular dynamics simulations. ,

92: 227-235
Clicks: 297
2019 Nyangiwe, N N, Ouma, C N M,

Modelling the adsorption of natural organic matter on Ag (111) surface: Insights from dispersion corrected density functional theory calculations. ,

92: 313-319
Clicks: 295

Certificate of Indexing

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journal of molecular graphics & modelling

ISSN: 1873-4243

is being indexed by Journament

Indexing started on: July 15, 2019
Certificate issued on: July 4, 2025
Verification link: https://www.journament.com/journal/706

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