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Application

Discovery Studio 0.9630143319463708 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05961904761904762 Amorphous Cell 0.2864761904761905 Blends 0.002285714285714286 CASTEP 0.3356190476190476 CDOCKER 0.16476190476190475 CHARMm 0.2611428571428571 COMPASS 0.3426666666666667 COMPASS III 0.10628571428571429 COSMObase 0.004761904761904762 COSMOconf 0.006095238095238095 COSMOmic 0.0 COSMOperm 3.8095238095238096E-4 COSMOplex 1.9047619047619048E-4 COSMOquick 0.001142857142857143 COSMOtherm 0.06533333333333333 Catalyst 0.08133333333333333 Classical Simulations 1.0 Conformers 3.8095238095238096E-4 Crystallization 0.07161904761904762 DFTB Plus 0.003619047619047619 DMol3 0.1540952380952381 DPD 0.0020952380952380953 Discover 0.0038095238095238095 Forcite 0.5312380952380953 GULP 0.019238095238095238 Kinetix 1.9047619047619048E-4 LUDI 0.0038095238095238095 LibDock 0.06914285714285714 LigandFit 0.004 MCSS 3.8095238095238096E-4 MODELER 0.2464761904761905 MesoDyn 5.714285714285715E-4 Mesocite 0.002857142857142857 Mesoscale 0.005333333333333333 Modules 0.0 Morphology 0.01638095238095238 ONETEP 9.523809523809524E-4 Polymorph 0.0020952380952380953 QMERA 1.9047619047619048E-4 QSAR 5.714285714285715E-4 Quantum Mechanics 0.48019047619047617 Reflex 0.052 Reflex Plus 7.619047619047619E-4 Semi-empirical 0.005333333333333333 Sorption 0.058095238095238096 Synthia 0.001142857142857143 TURBOMOLE 1.9047619047619048E-4 VAMP 0.001142857142857143 Visualization 0.6971428571428572 X-Cell 0.0015238095238095239 ZDOCK 0.02780952380952381

Year

2023 1.5229972586049346E-4 2024 0.45248248553152604 2025 1.0 2026 0.6443801401157478 2027 0.0

Keywords

target 1.0 potential 0.3003027800715662 docking 0.21396458390678044 analysis 0.21185429855950086 visualization 0.1624002202036884 between 0.14762822277273144 novel 0.09477933755390403 promising 0.08285163776493257 energy 0.0794568309019176 binding 0.06918065877603449 cell 0.06514359115515185 activity 0.04633452610331223 performance 0.042113955408753095 stability 0.03982016698779704 including 0.022203871914854574 experimental 0.017341040462427744 synthesized 0.016698779704560053 effective 0.016331773557207083 mechanism 0.015506009725662904 development 0.01486374896779521 enhanced 0.012202954399486191 interaction 0.009817414441691898 strong 0.006789613726029911 design 9.175153683824204E-4 protein 0.0
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