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Application

Discovery Studio 1.0 Materials Studio 0.9766981890104457 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0670680715838769 Amorphous Cell 0.2785582873390199 Blends 0.002508780732563974 CASTEP 0.40023415286837266 CDOCKER 0.17536377320622176 CHARMm 0.2606623181133969 COMPASS 0.3652784746613146 COMPASS III 0.0776049506606456 COSMObase 0.003177788927914367 COSMOconf 0.0035959190500083624 COSMOmic 1.6725204883759825E-4 COSMOperm 0.001338016390700786 COSMOplex 2.508780732563974E-4 COSMOquick 0.001254390366281987 COSMOtherm 0.06263589228968054 Cantera 8.362602441879912E-5 Catalyst 0.12786419133634386 Classical Simulations 1.0 Conformers 9.198862686067904E-4 Crystallization 0.07409265763505603 DFTB Plus 0.006021073758153537 DMol3 0.1823883592574009 DPD 0.0030105368790767687 Discover 0.00384679712326476 Forcite 0.5331995316942633 GULP 0.02567318949657133 Kinetix 2.508780732563974E-4 LUDI 0.005017561465127948 LibDock 0.07175112895132965 LigandFit 0.006690081953503931 MCSS 0.0010035122930255895 MODELER 0.1824719852818197 MesoDyn 0.0015888944639571834 Mesocite 0.004097675196521157 Mesoscale 0.00769359424652952 Modules 0.0 Morphology 0.01731058705469142 ONETEP 9.198862686067904E-4 Polymorph 0.0018397725372135808 QMERA 2.508780732563974E-4 QSAR 0.0011707643418631879 Quantum Mechanics 0.5714166248536544 Reflex 0.054524167921057035 Reflex Plus 7.526342197691922E-4 Semi-empirical 0.008028098344204716 Sorption 0.05393878575012544 Synthia 0.0015052684395383843 TURBOMOLE 5.853821709315939E-4 VAMP 0.0015888944639571834 Visualization 0.8734738250543569 X-Cell 0.0011707643418631879 ZDOCK 0.02977086469309249

Year

2021 0.07162872154115586 2022 0.27705779334500874 2023 0.3788966725043783 2024 0.8972854640980735 2025 1.0 2026 0.3722416812609457 2027 0.0

Keywords

target 1.0 potential 0.26902812388750447 docking 0.22007831968672126 visualization 0.21178355286578854 analysis 0.18344606621573514 between 0.14966180135279458 novel 0.1016375934496262 energy 0.08070487718049128 binding 0.07116411534353863 cell 0.05923816304734781 activity 0.05229619081523674 promising 0.04781060875756497 interaction 0.03791384834460662 synthesized 0.030153079387682448 stability 0.029369882520469917 experimental 0.02673549305802777 protein 0.01936632253470986 performance 0.01876112495550018 effective 0.018155927376290494 mechanism 0.01680313278746885 development 0.016197935208259167 synthesis 0.012637949448202207 including 0.010430758276966892 chemical 6.763972944108223E-4 design 0.0
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